{
  "checked_at": "2026-10-14T13:02:48.837232+00:00",
  "host": {
    "platform": "macOS-27.0.1-arm64-arm-64bit-Mach-O",
    "python": "3.13.6"
  },
  "corpus_sha256": "f48777e96f74738336f47f682fbff5af6775a3474fe25daa28b595340feee95f",
  "blocks": 21,
  "repeats_per_block": 5,
  "protocol": "Sequential fresh processes; rotating engine and operation order; 1000 parse-plus-calculation calls, or 50 calls per prepared molecule on 1000 molecules, per repeat; native results retained; imports, file reads, normalization and comparison outside timer; reused-mode parsing and one preparation call per molecule also outside timer",
  "settings": {
    "morgan_radius": 2,
    "morgan_bits": 2048,
    "include_chirality": false,
    "count_simulation": false,
    "tpsa_include_s_and_p": false
  },
  "slices": [
    {
      "offset": 0,
      "rows": 1000,
      "engine_orders": [
        [
          "v113",
          "v114",
          "rdkit"
        ],
        [
          "v114",
          "rdkit",
          "v113"
        ],
        [
          "rdkit",
          "v113",
          "v114"
        ],
        [
          "v113",
          "v114",
          "rdkit"
        ],
        [
          "v114",
          "rdkit",
          "v113"
        ],
        [
          "rdkit",
          "v113",
          "v114"
        ],
        [
          "v113",
          "v114",
          "rdkit"
        ],
        [
          "v114",
          "rdkit",
          "v113"
        ],
        [
          "rdkit",
          "v113",
          "v114"
        ],
        [
          "v113",
          "v114",
          "rdkit"
        ],
        [
          "v114",
          "rdkit",
          "v113"
        ],
        [
          "rdkit",
          "v113",
          "v114"
        ],
        [
          "v113",
          "v114",
          "rdkit"
        ],
        [
          "v114",
          "rdkit",
          "v113"
        ],
        [
          "rdkit",
          "v113",
          "v114"
        ],
        [
          "v113",
          "v114",
          "rdkit"
        ],
        [
          "v114",
          "rdkit",
          "v113"
        ],
        [
          "rdkit",
          "v113",
          "v114"
        ],
        [
          "v113",
          "v114",
          "rdkit"
        ],
        [
          "v114",
          "rdkit",
          "v113"
        ],
        [
          "rdkit",
          "v113",
          "v114"
        ]
      ],
      "tpsa_max_absolute_error": 0.0,
      "morgan_bits_equal": true,
      "summary": {
        "tpsa": {
          "median_ms_per_1000": {
            "v113": 6.918666,
            "v114": 5.590792,
            "rdkit": 73.375417
          },
          "v113_over_v114": {
            "median_speedup": 1.2190475180657716,
            "ci95": [
              1.1787971866096867,
              1.2424776168262541
            ],
            "faster_blocks": 20
          },
          "rdkit_over_v114": {
            "median_speedup": 13.087534141811428,
            "ci95": [
              12.90645955562587,
              13.686841250258233
            ],
            "faster_blocks": 21
          }
        },
        "morgan": {
          "median_ms_per_1000": {
            "v113": 12.609,
            "v114": 10.715833,
            "rdkit": 93.579167
          },
          "v113_over_v114": {
            "median_speedup": 1.1852604260308774,
            "ci95": [
              1.150998737559085,
              1.2051434180459468
            ],
            "faster_blocks": 19
          },
          "rdkit_over_v114": {
            "median_speedup": 8.709156804096299,
            "ci95": [
              8.40025912951677,
              8.970907432740539
            ],
            "faster_blocks": 21
          }
        },
        "tpsa_and_morgan": {
          "median_ms_per_1000": {
            "v113": 13.211208,
            "v114": 11.208792,
            "rdkit": 95.10425
          },
          "v113_over_v114": {
            "median_speedup": 1.1842421807497476,
            "ci95": [
              1.1314628190899,
              1.1966791838952766
            ],
            "faster_blocks": 18
          },
          "rdkit_over_v114": {
            "median_speedup": 8.50961850796883,
            "ci95": [
              8.067746603534097,
              8.903821571494948
            ],
            "faster_blocks": 21
          }
        },
        "tpsa_reused": {
          "median_ms_per_1000": {
            "v113": 0.38929834,
            "v114": 0.043875,
            "rdkit": 0.43324
          },
          "v113_over_v114": {
            "median_speedup": 8.985471619653604,
            "ci95": [
              8.660159218216844,
              9.270726182819793
            ],
            "faster_blocks": 21
          },
          "rdkit_over_v114": {
            "median_speedup": 9.785260932866,
            "ci95": [
              9.556888979821782,
              10.212244215345216
            ],
            "faster_blocks": 21
          }
        },
        "morgan_reused": {
          "median_ms_per_1000": {
            "v113": 3.96107916,
            "v114": 3.17778,
            "rdkit": 16.97478666
          },
          "v113_over_v114": {
            "median_speedup": 1.2463738453587343,
            "ci95": [
              1.2101615931037122,
              1.2653079686932502
            ],
            "faster_blocks": 21
          },
          "rdkit_over_v114": {
            "median_speedup": 5.292027459654603,
            "ci95": [
              5.0860004475978,
              5.623536415061051
            ],
            "faster_blocks": 21
          }
        }
      },
      "raw_timings_ns": {
        "v113": {
          "tpsa": [
            [
              7723917,
              5420833,
              5295875,
              5254625,
              5254291
            ],
            [
              7764000,
              7511167,
              7363959,
              7277209,
              7243042
            ],
            [
              6383083,
              6146042,
              5992250,
              5935375,
              6506125
            ],
            [
              6410000,
              6198333,
              6093459,
              6084792,
              6045750
            ],
            [
              6735083,
              6467042,
              6353084,
              6067125,
              5965291
            ],
            [
              6732834,
              6395208,
              6279000,
              6224542,
              6210209
            ],
            [
              7165750,
              6871666,
              7087083,
              7054125,
              7076667
            ],
            [
              12954958,
              10346583,
              10445791,
              11192083,
              10192083
            ],
            [
              7185750,
              6875459,
              6813000,
              6766750,
              6512291
            ],
            [
              7191042,
              6926291,
              6781208,
              6710625,
              6669000
            ],
            [
              7325250,
              7065791,
              6918666,
              6723666,
              6674750
            ],
            [
              9251416,
              8977084,
              8791000,
              8739084,
              8681042
            ],
            [
              7315667,
              7092042,
              7140875,
              6903084,
              6791417
            ],
            [
              7765667,
              7460542,
              7334875,
              7254500,
              7234292
            ],
            [
              7104500,
              6820584,
              6728667,
              6631250,
              6606875
            ],
            [
              7277500,
              6840833,
              6729375,
              6666416,
              7013208
            ],
            [
              7104125,
              6849125,
              6748000,
              6964791,
              7169584
            ],
            [
              7682167,
              7815000,
              7561875,
              7288417,
              7590917
            ],
            [
              8341166,
              8013875,
              8011167,
              8102000,
              8059375
            ],
            [
              7342000,
              6943334,
              7306166,
              7320500,
              7377708
            ],
            [
              7252417,
              6483583,
              6328166,
              6620125,
              6701792
            ]
          ],
          "morgan": [
            [
              10437875,
              9957333,
              9801042,
              9771750,
              9747667
            ],
            [
              13738709,
              13702709,
              13645916,
              13078000,
              13667500
            ],
            [
              11377375,
              11236291,
              11207666,
              11296791,
              11230958
            ],
            [
              11371833,
              11308042,
              11399250,
              11696959,
              11199834
            ],
            [
              11741041,
              11845000,
              11822667,
              11502167,
              11496209
            ],
            [
              11913542,
              11713458,
              11669875,
              11659375,
              11656583
            ],
            [
              12317833,
              11942417,
              11832458,
              11816000,
              11809459
            ],
            [
              20879208,
              20914041,
              22139667,
              22777833,
              23473833
            ],
            [
              11956833,
              11878750,
              11883667,
              11878292,
              11862208
            ],
            [
              12595542,
              12547958,
              12560791,
              12528958,
              12545000
            ],
            [
              12686459,
              12593959,
              12808791,
              12590708,
              12492083
            ],
            [
              27276583,
              26340208,
              27670417,
              27149667,
              26984208
            ],
            [
              12680167,
              12609000,
              12577291,
              12602958,
              12916458
            ],
            [
              13685167,
              14249417,
              13727583,
              13592458,
              13532958
            ],
            [
              12720125,
              13290416,
              12486459,
              13241000,
              13275625
            ],
            [
              13379542,
              12877625,
              12636625,
              12949166,
              13208292
            ],
            [
              13556667,
              12652292,
              12617041,
              12603333,
              12535458
            ],
            [
              13880375,
              13784750,
              13713417,
              13627834,
              14002333
            ],
            [
              14681375,
              14665583,
              14154417,
              14365708,
              15140083
            ],
            [
              12753625,
              12622875,
              12935167,
              12708458,
              12525167
            ],
            [
              12736833,
              11884542,
              12425333,
              11956125,
              12323750
            ]
          ],
          "tpsa_and_morgan": [
            [
              10411917,
              10286875,
              10275208,
              10271792,
              10259417
            ],
            [
              14577792,
              14286666,
              14032208,
              13499167,
              14250250
            ],
            [
              12397167,
              11842291,
              11778375,
              11767291,
              11763334
            ],
            [
              11968458,
              11791792,
              12340667,
              11851083,
              11773458
            ],
            [
              12628125,
              12296833,
              12032209,
              12292333,
              12248833
            ],
            [
              12395375,
              12278875,
              12256000,
              12305500,
              12230958
            ],
            [
              12629375,
              12468959,
              12473583,
              12400250,
              12438375
            ],
            [
              14795792,
              15429250,
              15269458,
              14549708,
              14872959
            ],
            [
              12620458,
              12480167,
              12445750,
              12442166,
              12409166
            ],
            [
              13377917,
              13291167,
              14272167,
              14257875,
              14953625
            ],
            [
              13302583,
              13127416,
              13230958,
              13167542,
              13195791
            ],
            [
              28419334,
              28702750,
              27439917,
              28380417,
              27878917
            ],
            [
              14751333,
              14230458,
              14199292,
              14165958,
              14169250
            ],
            [
              14492208,
              14277500,
              14285833,
              14258375,
              14232958
            ],
            [
              13611083,
              13555917,
              13347916,
              13228791,
              13731542
            ],
            [
              13357084,
              13256000,
              13311375,
              13841333,
              13583750
            ],
            [
              13339667,
              13182875,
              13165916,
              13157417,
              13144750
            ],
            [
              12813458,
              13274375,
              12579000,
              13034833,
              13096417
            ],
            [
              15687250,
              15628292,
              15198541,
              15136708,
              15343750
            ],
            [
              13611958,
              13489042,
              13295708,
              13247916,
              13234041
            ],
            [
              13388375,
              12634708,
              12982625,
              13211208,
              13448834
            ]
          ],
          "tpsa_reused": [
            [
              15467250,
              15357875,
              15375958,
              15300667,
              15457667
            ],
            [
              21500333,
              20565250,
              20732084,
              20974584,
              20939583
            ],
            [
              17372083,
              17186542,
              17381125,
              17184750,
              17202833
            ],
            [
              19097209,
              18945084,
              18823209,
              19150792,
              21459667
            ],
            [
              18322792,
              18429000,
              17817834,
              18286792,
              18262667
            ],
            [
              19321000,
              19087792,
              18912875,
              18925750,
              18788958
            ],
            [
              18386292,
              18117166,
              18142167,
              17931625,
              17964500
            ],
            [
              23172667,
              22903416,
              21725417,
              22782708,
              21785334
            ],
            [
              18458042,
              18330416,
              18373792,
              18319042,
              18411666
            ],
            [
              21709125,
              21125250,
              21156709,
              21239667,
              21902166
            ],
            [
              20245541,
              20008417,
              19851083,
              19864959,
              19826458
            ],
            [
              42197666,
              40557458,
              42237375,
              37519542,
              36447750
            ],
            [
              20288417,
              19338625,
              19417375,
              19690792,
              19774791
            ],
            [
              19646959,
              19412708,
              19479292,
              19389250,
              19464917
            ],
            [
              19851583,
              19913458,
              20759292,
              19712417,
              20427833
            ],
            [
              19533750,
              20207792,
              19411583,
              19793125,
              20445834
            ],
            [
              19777166,
              19620417,
              19742334,
              20496125,
              20952042
            ],
            [
              19092792,
              19052208,
              19262291,
              19394333,
              18798583
            ],
            [
              25896750,
              24151333,
              25143083,
              22865375,
              21600167
            ],
            [
              20924166,
              19905125,
              19363959,
              19317708,
              19292000
            ],
            [
              19037458,
              19320875,
              19285250,
              19396417,
              19330750
            ]
          ],
          "morgan_reused": [
            [
              153119167,
              153814125,
              153774958,
              153420125,
              153391959
            ],
            [
              211397042,
              211106417,
              210584334,
              211530500,
              211216792
            ],
            [
              175472042,
              176937500,
              176485416,
              182538375,
              180184125
            ],
            [
              189866334,
              185051542,
              185203584,
              183420000,
              183395666
            ],
            [
              182104167,
              184790459,
              183719958,
              184045958,
              185076750
            ],
            [
              185431458,
              188351958,
              188307042,
              185144792,
              184891917
            ],
            [
              185705333,
              186252708,
              186356292,
              194866500,
              208623583
            ],
            [
              231653250,
              262576916,
              250404083,
              259305000,
              284006833
            ],
            [
              185465875,
              185330584,
              193639542,
              195758458,
              187945333
            ],
            [
              224872584,
              214518000,
              198619375,
              201024708,
              199271375
            ],
            [
              196733125,
              198053958,
              197462292,
              198369208,
              202780167
            ],
            [
              353153333,
              315570375,
              280636833,
              263036959,
              261573084
            ],
            [
              196562958,
              197309625,
              197751458,
              187803625,
              191018834
            ],
            [
              196687000,
              243958292,
              298638916,
              297538375,
              235520750
            ],
            [
              200944791,
              201560000,
              203596375,
              202211625,
              202006833
            ],
            [
              202931041,
              203887208,
              198834375,
              205522084,
              199257125
            ],
            [
              200542542,
              203836875,
              202560625,
              203793208,
              200214458
            ],
            [
              196178792,
              197802083,
              198325417,
              198840542,
              201900417
            ],
            [
              234476292,
              239774708,
              243969375,
              237362208,
              241947833
            ],
            [
              196970667,
              196968041,
              196036459,
              196551291,
              196709084
            ],
            [
              197291375,
              198296375,
              196672625,
              197148291,
              197290125
            ]
          ]
        },
        "v114": {
          "tpsa": [
            [
              7135667,
              4479583,
              4409750,
              4733167,
              4663208
            ],
            [
              5308333,
              5156459,
              5008459,
              4962875,
              4879042
            ],
            [
              5545959,
              5358541,
              5167167,
              5117875,
              5550667
            ],
            [
              5293625,
              5123959,
              4998541,
              4930834,
              4855167
            ],
            [
              5585500,
              5321958,
              5195667,
              5107125,
              5139834
            ],
            [
              8027625,
              5278375,
              5155250,
              5114750,
              5052750
            ],
            [
              5842792,
              5524500,
              5284500,
              5188125,
              5169166
            ],
            [
              5988166,
              5758250,
              5566833,
              5553167,
              5457542
            ],
            [
              7220542,
              6917375,
              6659334,
              7862917,
              7270083
            ],
            [
              6375416,
              6098750,
              6002417,
              5951833,
              5913625
            ],
            [
              6086875,
              5722209,
              5689375,
              5794709,
              5669833
            ],
            [
              6385333,
              6196042,
              5930125,
              5821958,
              5887584
            ],
            [
              5582125,
              5404708,
              5232833,
              5159583,
              5500959
            ],
            [
              5899042,
              5763083,
              5555125,
              5536209,
              5432792
            ],
            [
              6307583,
              6173667,
              5720625,
              5498458,
              5514958
            ],
            [
              6115291,
              5759958,
              5590792,
              5550708,
              5555625
            ],
            [
              6430792,
              5798167,
              5634459,
              5601250,
              5540208
            ],
            [
              6663250,
              6326667,
              6109500,
              5951750,
              5845000
            ],
            [
              6856375,
              6800167,
              6540167,
              6633333,
              6498917
            ],
            [
              7652125,
              6897292,
              7045791,
              6771625,
              7221167
            ],
            [
              6136167,
              5768500,
              5616000,
              5610584,
              5557875
            ]
          ],
          "morgan": [
            [
              8844375,
              8762333,
              8475542,
              8515250,
              8442417
            ],
            [
              10300958,
              9704000,
              9579208,
              9549500,
              9538291
            ],
            [
              10117375,
              9973209,
              9901583,
              9898250,
              9874084
            ],
            [
              9506834,
              9884125,
              9594375,
              9536209,
              9886208
            ],
            [
              10026416,
              9961042,
              9975333,
              9942041,
              9927791
            ],
            [
              10132917,
              9870291,
              9892458,
              9844792,
              9864792
            ],
            [
              11236541,
              10811625,
              11573166,
              11219875,
              10899625
            ],
            [
              10689584,
              10601041,
              10589042,
              10575209,
              10614917
            ],
            [
              13317583,
              13654375,
              13057625,
              13166667,
              13065292
            ],
            [
              11371417,
              11193042,
              11191125,
              10957375,
              10768083
            ],
            [
              10884291,
              10727875,
              10693791,
              10855041,
              11279875
            ],
            [
              14580667,
              14046250,
              14402542,
              14114250,
              13992666
            ],
            [
              10144458,
              10240375,
              10130417,
              9892250,
              9935458
            ],
            [
              10751542,
              10650750,
              10596959,
              10508583,
              10483333
            ],
            [
              10715833,
              10699667,
              11276958,
              10896291,
              10617750
            ],
            [
              10966500,
              10743500,
              10795291,
              10728959,
              10744917
            ],
            [
              11027875,
              10598333,
              10522959,
              10493458,
              10478666
            ],
            [
              11506000,
              11377666,
              11562000,
              11932667,
              11817041
            ],
            [
              12291417,
              12302625,
              12447875,
              12379458,
              12070500
            ],
            [
              14479833,
              13472709,
              13228583,
              12856792,
              14384500
            ],
            [
              10947459,
              10810209,
              10756833,
              10711667,
              10707542
            ]
          ],
          "tpsa_and_morgan": [
            [
              8820708,
              8682917,
              8629292,
              8614666,
              8634792
            ],
            [
              10273958,
              10363208,
              10298833,
              10089708,
              10057625
            ],
            [
              10465292,
              9976166,
              9881167,
              10260500,
              10056000
            ],
            [
              10030583,
              10443042,
              10770125,
              10547084,
              10474125
            ],
            [
              10519666,
              10361458,
              10358208,
              10348250,
              10354542
            ],
            [
              10419167,
              10269125,
              10256291,
              10260791,
              10243208
            ],
            [
              11514209,
              11229958,
              11241417,
              11195792,
              11226333
            ],
            [
              17549541,
              17236459,
              16805125,
              16684167,
              16695459
            ],
            [
              13660917,
              13465541,
              13586542,
              13497958,
              13373708
            ],
            [
              11322541,
              11279709,
              11159542,
              11097083,
              11136166
            ],
            [
              11559125,
              11331459,
              12007667,
              11377875,
              11280625
            ],
            [
              14708875,
              14508167,
              14498375,
              15354583,
              14586458
            ],
            [
              11885750,
              11351583,
              11242417,
              11249167,
              11201125
            ],
            [
              11103458,
              10981708,
              10953584,
              10952750,
              10953125
            ],
            [
              11258125,
              11208792,
              11916917,
              11058959,
              11057333
            ],
            [
              11295167,
              12156708,
              11832667,
              11880833,
              11814708
            ],
            [
              11120167,
              11787792,
              11038708,
              10955292,
              11453209
            ],
            [
              12860958,
              12169875,
              12049292,
              11957459,
              11982083
            ],
            [
              12945750,
              12916833,
              12710542,
              13122459,
              12656166
            ],
            [
              14599084,
              13680583,
              14017542,
              13876708,
              12820500
            ],
            [
              11298375,
              11176625,
              11143583,
              11155833,
              11137125
            ]
          ],
          "tpsa_reused": [
            [
              1773541,
              1645292,
              1638417,
              1611916,
              1699500
            ],
            [
              2091875,
              1946416,
              1944042,
              1971500,
              1935750
            ],
            [
              2041333,
              1941750,
              1969250,
              2104042,
              1948958
            ],
            [
              2026625,
              1986667,
              1898292,
              1985166,
              1936875
            ],
            [
              2156792,
              1999458,
              2021000,
              2045333,
              2013250
            ],
            [
              2209958,
              2054125,
              2040625,
              2134334,
              2132167
            ],
            [
              2278125,
              2142875,
              2197792,
              2162750,
              2156791
            ],
            [
              3385125,
              3485333,
              3376791,
              3303792,
              2896041
            ],
            [
              2012042,
              2004625,
              2066458,
              2071041,
              1981792
            ],
            [
              2364166,
              2251875,
              2218959,
              2184833,
              2169583
            ],
            [
              2293833,
              2173583,
              2127333,
              2395417,
              2366291
            ],
            [
              2956459,
              2876041,
              2803917,
              2837125,
              2782917
            ],
            [
              2243875,
              2157125,
              2184417,
              2115583,
              2146166
            ],
            [
              2279292,
              2254250,
              2180333,
              2249250,
              2181416
            ],
            [
              2318125,
              2140625,
              2480583,
              2290250,
              2328375
            ],
            [
              2260083,
              2141458,
              2202792,
              2219625,
              2155000
            ],
            [
              2238625,
              2113083,
              2120208,
              2159000,
              2133292
            ],
            [
              2488209,
              2340541,
              2329125,
              2378084,
              2312542
            ],
            [
              2515333,
              2456167,
              2404333,
              2409417,
              2438917
            ],
            [
              2987917,
              2749916,
              2752750,
              2720500,
              2681042
            ],
            [
              2324500,
              2193750,
              2156333,
              2196375,
              2178125
            ]
          ],
          "morgan_reused": [
            [
              120861291,
              120893750,
              121863708,
              122109000,
              121528500
            ],
            [
              140197333,
              139876500,
              139524417,
              140154042,
              139271791
            ],
            [
              141342084,
              142118708,
              161518334,
              159106209,
              152523375
            ],
            [
              146718875,
              145718666,
              146586958,
              147971875,
              144220000
            ],
            [
              185996166,
              158219458,
              157641500,
              149372125,
              154146625
            ],
            [
              148146250,
              151779000,
              150306875,
              154041666,
              151455125
            ],
            [
              158026541,
              153377875,
              155494750,
              154953125,
              152624666
            ],
            [
              208176000,
              187480042,
              170975958,
              169366833,
              158004791
            ],
            [
              151876083,
              152767291,
              157094292,
              171624333,
              183890958
            ],
            [
              160438167,
              157210042,
              158302666,
              159227041,
              158889000
            ],
            [
              165677875,
              164677000,
              164310208,
              166069500,
              167462250
            ],
            [
              206096583,
              205781000,
              200390500,
              180755458,
              167233417
            ],
            [
              156033542,
              158702417,
              159978375,
              160717833,
              153538750
            ],
            [
              179385583,
              184193417,
              172162625,
              168120875,
              156492958
            ],
            [
              161337000,
              167743375,
              164076917,
              163759250,
              163779541
            ],
            [
              160000500,
              160947917,
              162025083,
              160380750,
              158465084
            ],
            [
              160429375,
              162329875,
              162519958,
              163787292,
              162959333
            ],
            [
              164074208,
              163851291,
              163883417,
              159299875,
              166154459
            ],
            [
              177566667,
              180968500,
              180165125,
              178742000,
              175725625
            ],
            [
              178875791,
              182465542,
              187885708,
              181674292,
              190045375
            ],
            [
              157389250,
              157102250,
              155352750,
              154818500,
              154704125
            ]
          ]
        },
        "rdkit": {
          "tpsa": [
            [
              57991291,
              57018916,
              56981166,
              57141041,
              58692417
            ],
            [
              80307459,
              79788292,
              80724250,
              80236875,
              80169541
            ],
            [
              73014750,
              73945583,
              73107958,
              73341500,
              74454666
            ],
            [
              65652834,
              67311959,
              66478833,
              66303458,
              68191417
            ],
            [
              67114292,
              66402708,
              67057666,
              66813000,
              67182709
            ],
            [
              68586709,
              67624041,
              67281791,
              66806083,
              66432625
            ],
            [
              74532959,
              112510959,
              108401458,
              141040500,
              158674000
            ],
            [
              86226833,
              86038541,
              86949541,
              87785334,
              87596042
            ],
            [
              97205791,
              98104000,
              97133167,
              97827084,
              88098666
            ],
            [
              73512875,
              73341292,
              73375417,
              73349167,
              78666208
            ],
            [
              112087500,
              112799083,
              110138875,
              111624542,
              112380250
            ],
            [
              164841708,
              165701583,
              168304916,
              165423333,
              163362833
            ],
            [
              73611292,
              72820875,
              72848292,
              72950292,
              72931584
            ],
            [
              135210833,
              133481042,
              131512458,
              126314125,
              104307000
            ],
            [
              75195250,
              74868875,
              75201417,
              73663625,
              74823166
            ],
            [
              73351417,
              72953042,
              72940291,
              72926583,
              73078166
            ],
            [
              73719500,
              73477958,
              72859708,
              74058375,
              75819292
            ],
            [
              73872958,
              73591500,
              73226708,
              73164458,
              72444875
            ],
            [
              85867084,
              84956208,
              84830584,
              85566833,
              84527166
            ],
            [
              72113917,
              71587166,
              71100916,
              72145709,
              70757583
            ],
            [
              71756250,
              70727792,
              70586625,
              70587708,
              70170958
            ]
          ],
          "morgan": [
            [
              72388500,
              123745041,
              169830959,
              129765458,
              137435209
            ],
            [
              98956958,
              100939292,
              99816375,
              97758458,
              97244125
            ],
            [
              90824375,
              86750084,
              86000541,
              85937333,
              83547500
            ],
            [
              85915042,
              87566625,
              91419750,
              86070250,
              85690875
            ],
            [
              83520875,
              83935708,
              85218792,
              83675334,
              83092333
            ],
            [
              84345625,
              83917000,
              83817250,
              83986083,
              85608042
            ],
            [
              85760791,
              87801209,
              88819833,
              86596458,
              86394000
            ],
            [
              105311709,
              105743958,
              103783083,
              104734250,
              107789542
            ],
            [
              106874083,
              100124792,
              97739458,
              91787292,
              92087584
            ],
            [
              99523709,
              99184459,
              99333792,
              100091000,
              98583708
            ],
            [
              135559417,
              136395833,
              123955916,
              124411000,
              120971958
            ],
            [
              102637750,
              102153708,
              103034125,
              99507625,
              97069500
            ],
            [
              97461459,
              93591791,
              93125250,
              92913375,
              92757166
            ],
            [
              122059208,
              119095667,
              108530417,
              102947958,
              98905250
            ],
            [
              94764334,
              93706917,
              93256250,
              92957875,
              95567166
            ],
            [
              91444750,
              91185709,
              96590375,
              95235083,
              93579167
            ],
            [
              92354542,
              91628250,
              91880166,
              89975416,
              90859708
            ],
            [
              89362625,
              89087417,
              89709417,
              90249167,
              90478875
            ],
            [
              110118459,
              106765625,
              109378000,
              107543000,
              117558250
            ],
            [
              89141250,
              90747084,
              88823625,
              89336875,
              91481042
            ],
            [
              88172167,
              88879792,
              89092166,
              86146500,
              86035000
            ]
          ],
          "tpsa_and_morgan": [
            [
              225613500,
              249985292,
              234124542,
              296941083,
              230095250
            ],
            [
              102696542,
              100576167,
              103570791,
              103532209,
              100971250
            ],
            [
              105246000,
              102676417,
              102632542,
              103504417,
              104171958
            ],
            [
              89061500,
              89021541,
              89778583,
              93706875,
              94259833
            ],
            [
              85671584,
              86632541,
              86714834,
              88112125,
              86756250
            ],
            [
              88967334,
              87794209,
              87315417,
              86609084,
              86596208
            ],
            [
              89456208,
              90813125,
              93840375,
              90398584,
              89189750
            ],
            [
              84845958,
              89034708,
              89478125,
              88351750,
              87030625
            ],
            [
              94470125,
              96156167,
              94847625,
              89694083,
              89017583
            ],
            [
              101067042,
              99147708,
              95412792,
              96645125,
              99207250
            ],
            [
              120602083,
              112683542,
              107488083,
              104785083,
              101431541
            ],
            [
              98134458,
              96748500,
              95330583,
              101109333,
              98271459
            ],
            [
              112318750,
              127431500,
              122936875,
              119760250,
              112290458
            ],
            [
              102035000,
              96368416,
              93516042,
              95104250,
              94597958
            ],
            [
              100686500,
              98263417,
              97512833,
              99801084,
              101354250
            ],
            [
              95737708,
              93993166,
              94125625,
              95462959,
              98191625
            ],
            [
              94723416,
              94533917,
              95186542,
              93601959,
              93200916
            ],
            [
              94773167,
              94434250,
              93352500,
              93198542,
              93166667
            ],
            [
              129092541,
              138125750,
              128903375,
              124636209,
              116216916
            ],
            [
              92052291,
              92352000,
              92519791,
              94371708,
              92346792
            ],
            [
              88917458,
              90072875,
              90856125,
              91764542,
              91216042
            ]
          ],
          "tpsa_reused": [
            [
              58929250,
              53825125,
              67350917,
              71837500,
              60862667
            ],
            [
              23623958,
              23814667,
              22809083,
              22889667,
              23069000
            ],
            [
              24806250,
              24403750,
              23878917,
              23894916,
              25058333
            ],
            [
              19260792,
              20300458,
              20273000,
              20019250,
              20391000
            ],
            [
              19799334,
              20853375,
              19990209,
              20584250,
              20754458
            ],
            [
              19389584,
              20156958,
              20575917,
              20502375,
              20368916
            ],
            [
              20475833,
              20117625,
              21112958,
              21472084,
              21231834
            ],
            [
              20585167,
              20372667,
              20234167,
              20159208,
              20214458
            ],
            [
              31071292,
              30463041,
              29826833,
              29735375,
              25691084
            ],
            [
              23902541,
              24906292,
              25922750,
              23823750,
              23761625
            ],
            [
              21710750,
              21293084,
              21085958,
              21073875,
              21457292
            ],
            [
              22236292,
              22327625,
              21612250,
              21938292,
              22472084
            ],
            [
              25658042,
              25221042,
              25295708,
              25761000,
              25668958
            ],
            [
              22184083,
              21538542,
              22695083,
              21662000,
              21633875
            ],
            [
              22683458,
              22778500,
              22201500,
              23009333,
              22242375
            ],
            [
              22763833,
              22433750,
              21995583,
              22194667,
              22125625
            ],
            [
              21917791,
              21842917,
              21368083,
              21518958,
              21335000
            ],
            [
              21401500,
              21299792,
              21085792,
              21764000,
              21796958
            ],
            [
              23308459,
              22340334,
              23652208,
              22967875,
              23916250
            ],
            [
              20942417,
              21829958,
              21642417,
              21411708,
              21933958
            ],
            [
              21723417,
              21381250,
              21214000,
              21048583,
              21098042
            ]
          ],
          "morgan_reused": [
            [
              2063839375,
              1226061208,
              924387750,
              1366984709,
              935274583
            ],
            [
              870128125,
              885951250,
              900012958,
              896031875,
              885306375
            ],
            [
              902172792,
              880192000,
              895513083,
              906386792,
              887557125
            ],
            [
              772005958,
              740117333,
              745541334,
              745431334,
              753599375
            ],
            [
              747841500,
              740395334,
              750076625,
              733340000,
              741741792
            ],
            [
              755876083,
              767456167,
              768699375,
              769042542,
              773234167
            ],
            [
              837476375,
              829732916,
              787659834,
              791781792,
              921606958
            ],
            [
              863243459,
              980208875,
              998823458,
              981727041,
              980089334
            ],
            [
              980994667,
              968458834,
              1459276000,
              2981139667,
              1417463333
            ],
            [
              851886583,
              1031222500,
              936669166,
              977980375,
              930676625
            ],
            [
              882012792,
              850526459,
              868353333,
              837526792,
              889664458
            ],
            [
              911020042,
              929330667,
              1157756500,
              863439958,
              972795959
            ],
            [
              915156250,
              845213792,
              898832458,
              830231042,
              833138958
            ],
            [
              797951167,
              777201333,
              968162791,
              1210608250,
              1753720708
            ],
            [
              822425333,
              806493458,
              829563791,
              811601000,
              839625167
            ],
            [
              887543500,
              895396000,
              808376042,
              848739333,
              808631334
            ],
            [
              839556250,
              817944625,
              848350958,
              897316708,
              849573792
            ],
            [
              814209291,
              824938584,
              818373959,
              798041458,
              807687750
            ],
            [
              998224666,
              952234000,
              943709166,
              980792250,
              932319625
            ],
            [
              840700416,
              814970875,
              837819250,
              820627334,
              816065291
            ],
            [
              811961750,
              811630167,
              861085000,
              824316875,
              814405708
            ]
          ]
        }
      }
    },
    {
      "offset": 5000,
      "rows": 1000,
      "engine_orders": [
        [
          "v113",
          "v114",
          "rdkit"
        ],
        [
          "v114",
          "rdkit",
          "v113"
        ],
        [
          "rdkit",
          "v113",
          "v114"
        ],
        [
          "v113",
          "v114",
          "rdkit"
        ],
        [
          "v114",
          "rdkit",
          "v113"
        ],
        [
          "rdkit",
          "v113",
          "v114"
        ],
        [
          "v113",
          "v114",
          "rdkit"
        ],
        [
          "v114",
          "rdkit",
          "v113"
        ],
        [
          "rdkit",
          "v113",
          "v114"
        ],
        [
          "v113",
          "v114",
          "rdkit"
        ],
        [
          "v114",
          "rdkit",
          "v113"
        ],
        [
          "rdkit",
          "v113",
          "v114"
        ],
        [
          "v113",
          "v114",
          "rdkit"
        ],
        [
          "v114",
          "rdkit",
          "v113"
        ],
        [
          "rdkit",
          "v113",
          "v114"
        ],
        [
          "v113",
          "v114",
          "rdkit"
        ],
        [
          "v114",
          "rdkit",
          "v113"
        ],
        [
          "rdkit",
          "v113",
          "v114"
        ],
        [
          "v113",
          "v114",
          "rdkit"
        ],
        [
          "v114",
          "rdkit",
          "v113"
        ],
        [
          "rdkit",
          "v113",
          "v114"
        ]
      ],
      "tpsa_max_absolute_error": 0.0,
      "morgan_bits_equal": true,
      "summary": {
        "tpsa": {
          "median_ms_per_1000": {
            "v113": 8.493375,
            "v114": 7.951167,
            "rdkit": 33.914209
          },
          "v113_over_v114": {
            "median_speedup": 1.0708106181807153,
            "ci95": [
              1.0380812705431988,
              1.1150198322738154
            ],
            "faster_blocks": 17
          },
          "rdkit_over_v114": {
            "median_speedup": 4.227074222378044,
            "ci95": [
              3.8860301874605123,
              4.263732469049555
            ],
            "faster_blocks": 21
          }
        },
        "morgan": {
          "median_ms_per_1000": {
            "v113": 11.301625,
            "v114": 10.212125,
            "rdkit": 42.568584
          },
          "v113_over_v114": {
            "median_speedup": 1.0844805365579977,
            "ci95": [
              1.0549655080548104,
              1.1159216705063477
            ],
            "faster_blocks": 19
          },
          "rdkit_over_v114": {
            "median_speedup": 4.175715448146552,
            "ci95": [
              3.959760720918092,
              4.225429655166614
            ],
            "faster_blocks": 21
          }
        },
        "tpsa_and_morgan": {
          "median_ms_per_1000": {
            "v113": 12.740459,
            "v114": 11.200375,
            "rdkit": 44.7555
          },
          "v113_over_v114": {
            "median_speedup": 1.1033364178904312,
            "ci95": [
              1.0790299421456846,
              1.1354463276836158
            ],
            "faster_blocks": 18
          },
          "rdkit_over_v114": {
            "median_speedup": 3.976915254237288,
            "ci95": [
              3.8729818726390843,
              4.254693857193058
            ],
            "faster_blocks": 21
          }
        },
        "tpsa_reused": {
          "median_ms_per_1000": {
            "v113": 0.6509183399999999,
            "v114": 0.045313339999999994,
            "rdkit": 0.43587668
          },
          "v113_over_v114": {
            "median_speedup": 14.318892123583224,
            "ci95": [
              13.836202255679673,
              14.655511363636364
            ],
            "faster_blocks": 21
          },
          "rdkit_over_v114": {
            "median_speedup": 9.839614291467695,
            "ci95": [
              9.314632502819483,
              9.95678
            ],
            "faster_blocks": 21
          }
        },
        "morgan_reused": {
          "median_ms_per_1000": {
            "v113": 2.57393916,
            "v114": 1.8155558200000002,
            "rdkit": 9.24355668
          },
          "v113_over_v114": {
            "median_speedup": 1.4363931949080782,
            "ci95": [
              1.4200254773723537,
              1.4708735698381348
            ],
            "faster_blocks": 21
          },
          "rdkit_over_v114": {
            "median_speedup": 5.12053611588125,
            "ci95": [
              4.997101327566781,
              5.264669183229093
            ],
            "faster_blocks": 21
          }
        }
      },
      "raw_timings_ns": {
        "v113": {
          "tpsa": [
            [
              10738166,
              8428167,
              8349792,
              8290958,
              8300500
            ],
            [
              8889042,
              8506209,
              8213583,
              7853250,
              8493375
            ],
            [
              8758292,
              8409208,
              8330875,
              8300209,
              8246916
            ],
            [
              8744041,
              8414833,
              8332334,
              8264000,
              8254333
            ],
            [
              8889416,
              7924584,
              8039625,
              8338125,
              7931584
            ],
            [
              8607750,
              8044959,
              7823458,
              8232458,
              8565541
            ],
            [
              8722583,
              8323334,
              8073375,
              7720791,
              7721584
            ],
            [
              9005875,
              8608792,
              8034292,
              8011000,
              7981208
            ],
            [
              8846334,
              8489583,
              8275708,
              8484875,
              8459541
            ],
            [
              9480166,
              9340375,
              9366084,
              9136834,
              9035875
            ],
            [
              17474334,
              17090417,
              17018959,
              15919500,
              16076458
            ],
            [
              12072833,
              11676917,
              11799209,
              11654167,
              11739083
            ],
            [
              18410416,
              17673458,
              18666875,
              17955250,
              17551125
            ],
            [
              8725750,
              8374084,
              8308250,
              8259250,
              8242292
            ],
            [
              15131209,
              13165500,
              13153250,
              12332875,
              12982625
            ],
            [
              12305750,
              10486667,
              11169459,
              11742166,
              11439375
            ],
            [
              8937875,
              8598042,
              8510709,
              8513459,
              8429666
            ],
            [
              8791792,
              8498917,
              9237500,
              8901333,
              8729792
            ],
            [
              11732417,
              11226000,
              11118667,
              11025375,
              10958625
            ],
            [
              10397625,
              10329584,
              10125250,
              9895750,
              9821792
            ],
            [
              8775500,
              8280166,
              8209583,
              8154583,
              8135500
            ]
          ],
          "morgan": [
            [
              10967416,
              10849709,
              10821792,
              11168708,
              10872834
            ],
            [
              10785417,
              10761417,
              10626542,
              10362375,
              10856709
            ],
            [
              11070208,
              11333125,
              10937125,
              11327042,
              10958167
            ],
            [
              10979042,
              10894916,
              10816542,
              10843583,
              10865000
            ],
            [
              10599375,
              11271125,
              10307333,
              10629209,
              11444708
            ],
            [
              11495458,
              11440417,
              11322583,
              11304500,
              11274875
            ],
            [
              10620750,
              10151000,
              10086833,
              10240125,
              10630500
            ],
            [
              11065417,
              10613125,
              10671791,
              11474334,
              11001667
            ],
            [
              11008541,
              10482542,
              10259125,
              10327708,
              11289334
            ],
            [
              11859833,
              12037416,
              12032625,
              11843208,
              11756917
            ],
            [
              18418541,
              19364541,
              19041875,
              19471000,
              20243208
            ],
            [
              20697125,
              22215917,
              20500625,
              21164833,
              20491125
            ],
            [
              24007792,
              23094958,
              22499333,
              23777208,
              23752959
            ],
            [
              10926708,
              10910792,
              11639084,
              10779917,
              10762125
            ],
            [
              16595084,
              12837500,
              13245708,
              13197250,
              13270000
            ],
            [
              14089500,
              13176917,
              14594708,
              14889334,
              13852042
            ],
            [
              11431125,
              11198250,
              11301625,
              11410208,
              11219833
            ],
            [
              11390917,
              11431250,
              11264250,
              11382959,
              11196750
            ],
            [
              14487250,
              14370542,
              14298083,
              14308708,
              15830667
            ],
            [
              12985084,
              12897375,
              12818833,
              12869458,
              12164500
            ],
            [
              11191416,
              10981542,
              10857458,
              10816500,
              10789208
            ]
          ],
          "tpsa_and_morgan": [
            [
              12527625,
              12389042,
              12370584,
              12367041,
              12363709
            ],
            [
              11920166,
              12452542,
              11701875,
              12304833,
              11788583
            ],
            [
              13614208,
              12931625,
              13910667,
              13508917,
              13425584
            ],
            [
              12560875,
              12650208,
              13037208,
              12495708,
              12320083
            ],
            [
              12557542,
              12074625,
              12526791,
              12340542,
              12019041
            ],
            [
              12094625,
              11578333,
              11597291,
              11598750,
              11607334
            ],
            [
              11726459,
              12436167,
              11555000,
              11523541,
              12090292
            ],
            [
              12234834,
              11645417,
              11959833,
              12064750,
              11577000
            ],
            [
              12875667,
              12899875,
              11837875,
              12354541,
              12287709
            ],
            [
              13678209,
              13466584,
              13494917,
              13446959,
              13421167
            ],
            [
              23039500,
              23638958,
              24075584,
              24313667,
              23881084
            ],
            [
              23325250,
              23798334,
              24092959,
              24282250,
              24740541
            ],
            [
              19287917,
              17649750,
              17261959,
              17280208,
              18713667
            ],
            [
              12512709,
              12363125,
              12370458,
              12355125,
              12363834
            ],
            [
              15394958,
              14943833,
              14894917,
              15786375,
              15112542
            ],
            [
              16361917,
              16585542,
              15559958,
              16833250,
              15935667
            ],
            [
              12985583,
              12762333,
              12727625,
              12740459,
              12716667
            ],
            [
              12938917,
              12343541,
              12295334,
              12278667,
              12919583
            ],
            [
              22825291,
              20912375,
              16600375,
              16228125,
              16170166
            ],
            [
              13603458,
              13421542,
              13362292,
              13337917,
              13401375
            ],
            [
              12559791,
              13109959,
              13291542,
              13602500,
              13580250
            ]
          ],
          "tpsa_reused": [
            [
              32302000,
              31991666,
              31942875,
              31948583,
              32325166
            ],
            [
              31634750,
              31378208,
              31424250,
              32238458,
              31330208
            ],
            [
              32311500,
              32005458,
              31951875,
              31646459,
              32262667
            ],
            [
              33374000,
              31785416,
              32937750,
              32251583,
              32041084
            ],
            [
              31572375,
              32049833,
              31754792,
              32475500,
              32247000
            ],
            [
              30522500,
              31142791,
              30704334,
              30369875,
              30149083
            ],
            [
              33198125,
              33259208,
              32242125,
              32209125,
              31443750
            ],
            [
              31452583,
              31127833,
              31109583,
              30966458,
              30915333
            ],
            [
              30272750,
              31112125,
              30626416,
              30576625,
              31349083
            ],
            [
              35391042,
              36747750,
              35468625,
              34171583,
              34087750
            ],
            [
              60884291,
              61039625,
              55825416,
              59270042,
              56093459
            ],
            [
              64123417,
              65179375,
              59771708,
              51632958,
              53003292
            ],
            [
              45175541,
              45057333,
              45469250,
              44806708,
              45154625
            ],
            [
              32441458,
              32065083,
              31932917,
              31889666,
              32777041
            ],
            [
              43888209,
              39658833,
              39043167,
              38362292,
              38474584
            ],
            [
              41870125,
              42250125,
              41836250,
              41802250,
              41793250
            ],
            [
              33877666,
              33517750,
              33476875,
              33468417,
              33345208
            ],
            [
              33307333,
              33331333,
              31689292,
              31861792,
              32545917
            ],
            [
              32329166,
              32416459,
              36293959,
              34662458,
              34465250
            ],
            [
              35232000,
              34444875,
              34362959,
              36021875,
              35963792
            ],
            [
              35205708,
              34698375,
              34565125,
              34503625,
              34581375
            ]
          ],
          "morgan_reused": [
            [
              128426459,
              128696958,
              128060375,
              132382583,
              138481625
            ],
            [
              125573375,
              124930167,
              124864750,
              125706166,
              124943167
            ],
            [
              128302584,
              128207458,
              128976625,
              128281583,
              128256375
            ],
            [
              130725875,
              127683208,
              126909167,
              127170542,
              126843750
            ],
            [
              121921083,
              125670959,
              123252458,
              127123791,
              123299584
            ],
            [
              124109292,
              128240292,
              126787708,
              125037875,
              125813333
            ],
            [
              124524208,
              125257500,
              124786250,
              125754708,
              125264416
            ],
            [
              126418209,
              127737333,
              125622791,
              123618958,
              123697333
            ],
            [
              123725708,
              124348167,
              121813459,
              128213167,
              128010917
            ],
            [
              128173208,
              125009333,
              124529208,
              127729500,
              141850375
            ],
            [
              310868958,
              438127750,
              390807666,
              245912083,
              396632375
            ],
            [
              183570375,
              181331500,
              194396667,
              179909833,
              177217833
            ],
            [
              178836666,
              175319333,
              248873250,
              245646792,
              247024333
            ],
            [
              130187000,
              133840541,
              130434708,
              130480584,
              130578750
            ],
            [
              127740834,
              127963416,
              128056291,
              138736375,
              141472833
            ],
            [
              186211458,
              190191292,
              190337209,
              179867959,
              175061208
            ],
            [
              129425583,
              137578167,
              134405500,
              129577000,
              130574000
            ],
            [
              129399917,
              129032292,
              130933875,
              130743042,
              131601000
            ],
            [
              135783458,
              142431416,
              153400166,
              152866833,
              169605083
            ],
            [
              161822625,
              187746417,
              169085709,
              169441750,
              166456208
            ],
            [
              138789625,
              138395916,
              133581667,
              131509500,
              131257500
            ]
          ]
        },
        "v114": {
          "tpsa": [
            [
              11066000,
              8907083,
              9255750,
              8564000,
              8337333
            ],
            [
              8924666,
              8056458,
              7803792,
              7749208,
              7709833
            ],
            [
              8798000,
              8564041,
              8631167,
              8564417,
              8546625
            ],
            [
              8869542,
              8403000,
              7781333,
              7680167,
              7688791
            ],
            [
              8845958,
              8581625,
              8426375,
              8364167,
              8293917
            ],
            [
              8421000,
              8089000,
              7899417,
              7951167,
              7752292
            ],
            [
              8241292,
              7929417,
              7776416,
              7777209,
              7694875
            ],
            [
              8247625,
              7906209,
              7789292,
              7776167,
              7746958
            ],
            [
              8221292,
              8076750,
              7936833,
              7856250,
              7837583
            ],
            [
              8323042,
              8036791,
              7850834,
              7722333,
              7729209
            ],
            [
              10803584,
              10256666,
              10076334,
              10040917,
              9983458
            ],
            [
              10914625,
              10334250,
              10077500,
              11795000,
              11298334
            ],
            [
              10934542,
              11132417,
              11773875,
              10721000,
              11060000
            ],
            [
              8258625,
              7932458,
              7851375,
              7735500,
              7766250
            ],
            [
              10843875,
              10319292,
              10143666,
              10104917,
              10023125
            ],
            [
              10982333,
              10594541,
              10171250,
              10111625,
              9973458
            ],
            [
              8272625,
              8036166,
              7830959,
              7736042,
              7736417
            ],
            [
              7989750,
              7716625,
              7661708,
              7884875,
              7980042
            ],
            [
              8716792,
              8391416,
              8299041,
              8165333,
              8136500
            ],
            [
              12464125,
              11915959,
              11658834,
              11652375,
              11922875
            ],
            [
              8350125,
              7891250,
              7807042,
              7653291,
              7718167
            ]
          ],
          "morgan": [
            [
              11248000,
              11346083,
              10823125,
              10831208,
              10633500
            ],
            [
              10418875,
              9518500,
              9996000,
              9606166,
              10026750
            ],
            [
              11104125,
              10872750,
              10750292,
              10704833,
              10664333
            ],
            [
              10075750,
              10022167,
              9981708,
              9966083,
              9988708
            ],
            [
              10891417,
              10045958,
              9946333,
              10126125,
              10448375
            ],
            [
              10277833,
              9929125,
              9870167,
              9838250,
              9803833
            ],
            [
              10177416,
              9362500,
              9284583,
              9664792,
              9546959
            ],
            [
              10152083,
              10055292,
              10049500,
              10041167,
              9997958
            ],
            [
              10419250,
              10178166,
              9993375,
              10058875,
              10525875
            ],
            [
              10275542,
              10212125,
              10337125,
              10113333,
              10021042
            ],
            [
              13182625,
              13032958,
              12969125,
              12936666,
              12981667
            ],
            [
              16261208,
              13903584,
              13901250,
              13804208,
              13942833
            ],
            [
              15161125,
              13386250,
              13808792,
              14500417,
              14818542
            ],
            [
              10103167,
              10067625,
              9963208,
              9893542,
              9908166
            ],
            [
              13258666,
              13150500,
              13117750,
              13845875,
              13490834
            ],
            [
              13159000,
              13075709,
              13009250,
              12951041,
              12910292
            ],
            [
              11183791,
              10749042,
              10647250,
              10712791,
              10585333
            ],
            [
              10723708,
              10693417,
              10106250,
              10200500,
              10164916
            ],
            [
              10704542,
              10607541,
              10582208,
              10567375,
              10566417
            ],
            [
              15463375,
              13847292,
              15191625,
              15064334,
              14310166
            ],
            [
              10011667,
              9931959,
              10277750,
              10055000,
              9933334
            ]
          ],
          "tpsa_and_morgan": [
            [
              11902875,
              11881791,
              12873916,
              12927875,
              13150000
            ],
            [
              11590833,
              11092042,
              11027125,
              11021708,
              11004958
            ],
            [
              11666041,
              11076208,
              11020166,
              10969333,
              10924625
            ],
            [
              11241792,
              11068834,
              11062500,
              11046500,
              11047167
            ],
            [
              11415417,
              11184750,
              11126541,
              11110000,
              11719458
            ],
            [
              11064000,
              10923916,
              10894292,
              10889250,
              10902250
            ],
            [
              10438833,
              10907709,
              10247625,
              10769125,
              10468917
            ],
            [
              11878250,
              11185208,
              11083875,
              10965917,
              10920458
            ],
            [
              11496750,
              11143292,
              11959583,
              11490916,
              11137333
            ],
            [
              11192208,
              11067666,
              11066209,
              11000958,
              10988916
            ],
            [
              14585792,
              14396958,
              13081917,
              12921625,
              12913167
            ],
            [
              16369250,
              15513417,
              15793958,
              15883209,
              15239459
            ],
            [
              24407250,
              22659792,
              22188750,
              20056584,
              22235333
            ],
            [
              11169000,
              11031541,
              11022167,
              10975125,
              10972709
            ],
            [
              15203208,
              15027292,
              14794667,
              14712875,
              14792500
            ],
            [
              14485625,
              14335333,
              14355666,
              14842958,
              14655083
            ],
            [
              11904125,
              11764000,
              11764000,
              11728500,
              11974416
            ],
            [
              11840084,
              11055708,
              11233917,
              11200375,
              11027833
            ],
            [
              11981584,
              11775500,
              11888708,
              12620834,
              12149375
            ],
            [
              16453667,
              16251291,
              17311083,
              16972625,
              15374125
            ],
            [
              11123084,
              10972375,
              10926709,
              10915000,
              10940916
            ]
          ],
          "tpsa_reused": [
            [
              2670000,
              2549625,
              2598792,
              2572333,
              2592292
            ],
            [
              2300583,
              2211875,
              2177417,
              2157167,
              2173292
            ],
            [
              2293375,
              2143334,
              2101416,
              2129250,
              2109375
            ],
            [
              2243250,
              2156917,
              2170709,
              2165625,
              2206458
            ],
            [
              2419208,
              2309041,
              2316375,
              2347583,
              2158875
            ],
            [
              2263125,
              2243666,
              2184291,
              2181042,
              2207375
            ],
            [
              2288208,
              2217459,
              2160708,
              2137875,
              2200000
            ],
            [
              2279917,
              2184333,
              2163958,
              2168833,
              2172625
            ],
            [
              2188583,
              2182333,
              2249334,
              2169333,
              2181333
            ],
            [
              2294875,
              2148667,
              2171667,
              2150792,
              2157333
            ],
            [
              2724833,
              2980459,
              2960416,
              2711083,
              2630917
            ],
            [
              3133291,
              2850291,
              2931042,
              2928166,
              2894292
            ],
            [
              4604625,
              4903541,
              4183875,
              4245333,
              3712000
            ],
            [
              2276625,
              2247542,
              2273792,
              2248791,
              2260167
            ],
            [
              3006166,
              2864709,
              2839500,
              2834541,
              2878083
            ],
            [
              3014166,
              2880166,
              2871792,
              2788000,
              2626750
            ],
            [
              2458541,
              2345792,
              2340542,
              2369334,
              2281875
            ],
            [
              2265667,
              2144375,
              2197750,
              2383792,
              2321000
            ],
            [
              2991375,
              2862792,
              2792625,
              2983459,
              2971375
            ],
            [
              3030667,
              3034833,
              4285625,
              3204666,
              3193541
            ],
            [
              2274834,
              2185000,
              2180208,
              2230833,
              2382208
            ]
          ],
          "morgan_reused": [
            [
              97905041,
              98495125,
              95989000,
              95409375,
              93475167
            ],
            [
              94549666,
              105231958,
              95242292,
              95995333,
              95396625
            ],
            [
              88920583,
              90767459,
              88912459,
              89308125,
              95872667
            ],
            [
              88345375,
              90562291,
              88742875,
              87604292,
              90605167
            ],
            [
              88841708,
              88658625,
              89193459,
              88916000,
              89028417
            ],
            [
              87601167,
              87319083,
              87224083,
              87909709,
              87527334
            ],
            [
              86881250,
              87352458,
              88178583,
              87397083,
              86925416
            ],
            [
              88465167,
              88852042,
              89541208,
              88379958,
              88232250
            ],
            [
              86011791,
              87295792,
              86735500,
              87975833,
              88609375
            ],
            [
              88748750,
              88699250,
              89048000,
              88827709,
              88998625
            ],
            [
              115849417,
              105976458,
              108777958,
              107530792,
              105150833
            ],
            [
              123490750,
              126560459,
              123281500,
              121315500,
              121725416
            ],
            [
              161834375,
              164830459,
              129950208,
              123466250,
              123208125
            ],
            [
              88341709,
              88467042,
              88329417,
              88284250,
              88453208
            ],
            [
              105101041,
              107050625,
              116829708,
              117092000,
              117584833
            ],
            [
              103835292,
              103496042,
              103802375,
              103140541,
              100829667
            ],
            [
              95353042,
              90620750,
              90777791,
              89815542,
              91455583
            ],
            [
              94041125,
              91292125,
              93159750,
              95703375,
              91753750
            ],
            [
              113719167,
              103798000,
              103821250,
              97716333,
              95217375
            ],
            [
              143598083,
              140366542,
              130775167,
              128487000,
              130668541
            ],
            [
              92767750,
              94689250,
              90374042,
              89908750,
              89767458
            ]
          ]
        },
        "rdkit": {
          "tpsa": [
            [
              33997000,
              34654875,
              33295375,
              33309000,
              33603959
            ],
            [
              33335459,
              32996667,
              32126500,
              32155459,
              32987208
            ],
            [
              33567292,
              33116583,
              34321459,
              33281583,
              33194708
            ],
            [
              33458667,
              33168292,
              33451750,
              33055459,
              32950083
            ],
            [
              31807417,
              32344041,
              32151000,
              32056750,
              32365125
            ],
            [
              33472750,
              33056708,
              32111583,
              32125750,
              32922833
            ],
            [
              33660417,
              32806750,
              32979666,
              33519750,
              33067750
            ],
            [
              33648958,
              33375500,
              33541333,
              33195250,
              33247667
            ],
            [
              33571292,
              33769291,
              33225541,
              33236125,
              33084250
            ],
            [
              58089250,
              51922125,
              59132500,
              56411334,
              55862583
            ],
            [
              39747750,
              39562250,
              40039542,
              39951292,
              41259250
            ],
            [
              46624958,
              46537041,
              45938709,
              46093666,
              52434208
            ],
            [
              35718500,
              35404625,
              35335375,
              35400375,
              35370583
            ],
            [
              33901750,
              33257167,
              33236291,
              33124125,
              33143542
            ],
            [
              35983125,
              34438458,
              34861791,
              33741000,
              33637709
            ],
            [
              35987166,
              36191000,
              35723291,
              35536625,
              35691375
            ],
            [
              33914209,
              33242666,
              34209208,
              33550875,
              34825625
            ],
            [
              36590667,
              35709791,
              35629000,
              35666875,
              33374541
            ],
            [
              50925166,
              55047958,
              53227708,
              57553625,
              56174417
            ],
            [
              44034417,
              44868042,
              45049292,
              44548709,
              43582917
            ],
            [
              35690542,
              35208291,
              36483958,
              35482542,
              33063459
            ]
          ],
          "morgan": [
            [
              42923167,
              42450292,
              42494833,
              42020458,
              45601417
            ],
            [
              42306542,
              42393250,
              42189375,
              41961042,
              41747833
            ],
            [
              42629750,
              42937667,
              42069625,
              42568584,
              42256333
            ],
            [
              42206583,
              42151584,
              42939292,
              42816417,
              42077500
            ],
            [
              41391417,
              41546167,
              40631708,
              41422291,
              40766625
            ],
            [
              40601875,
              42110292,
              40557875,
              41391125,
              40354417
            ],
            [
              40550417,
              39566458,
              40917667,
              40825958,
              41199917
            ],
            [
              43092250,
              42615916,
              42145375,
              42414750,
              40727708
            ],
            [
              42762916,
              42501125,
              42834917,
              42292500,
              42336958
            ],
            [
              69951833,
              64537875,
              67796083,
              64131083,
              64893458
            ],
            [
              50816875,
              50373584,
              50469959,
              50547333,
              50384208
            ],
            [
              78160500,
              74553042,
              76723000,
              73878209,
              77363875
            ],
            [
              45284334,
              45209833,
              45760167,
              46224583,
              45092000
            ],
            [
              42891959,
              42324708,
              42177833,
              42066708,
              41551250
            ],
            [
              43281542,
              44346000,
              44481334,
              45553000,
              47245208
            ],
            [
              45824959,
              45504000,
              44920375,
              42203291,
              42905666
            ],
            [
              43454375,
              44133958,
              45721750,
              42667625,
              41943958
            ],
            [
              45026167,
              42841042,
              45690708,
              43295333,
              42691333
            ],
            [
              66582625,
              73526833,
              73580625,
              75683333,
              74355833
            ],
            [
              56727125,
              57625917,
              57335208,
              56308250,
              56204542
            ],
            [
              42277625,
              42047209,
              42548459,
              42085875,
              43843583
            ]
          ],
          "tpsa_and_morgan": [
            [
              44497708,
              44400750,
              44367042,
              44243958,
              42841084
            ],
            [
              43556958,
              46917041,
              47445917,
              47539167,
              44508792
            ],
            [
              43245583,
              42586417,
              43076417,
              42915625,
              43072042
            ],
            [
              44188667,
              43994625,
              43823125,
              43633750,
              44579709
            ],
            [
              43318334,
              43253750,
              43169041,
              43372208,
              45413667
            ],
            [
              43440542,
              43324500,
              42898958,
              43013084,
              43106000
            ],
            [
              44342917,
              43302000,
              43312959,
              44184125,
              43615625
            ],
            [
              45195208,
              43957875,
              43873250,
              43862875,
              43847250
            ],
            [
              44792000,
              44597167,
              43393083,
              43719625,
              43816542
            ],
            [
              67503708,
              60923167,
              58256167,
              58353167,
              58722625
            ],
            [
              59161250,
              62430541,
              58513750,
              59566750,
              59219584
            ],
            [
              77859583,
              76616459,
              74163000,
              74913958,
              70995750
            ],
            [
              111306750,
              263044083,
              85019333,
              81200292,
              101551041
            ],
            [
              44027916,
              44305042,
              44755500,
              45454375,
              45583459
            ],
            [
              46726125,
              47531250,
              45577667,
              45447958,
              45342042
            ],
            [
              44331916,
              44134834,
              44914958,
              44266750,
              48601666
            ],
            [
              44484000,
              44419333,
              44455375,
              44420000,
              44443583
            ],
            [
              44881500,
              44183292,
              46514166,
              44638083,
              45552041
            ],
            [
              76872750,
              77879084,
              77102083,
              72052750,
              76020334
            ],
            [
              60373459,
              59001666,
              59553291,
              59625417,
              59894625
            ],
            [
              47996333,
              47656209,
              47679083,
              47456625,
              47412500
            ]
          ],
          "tpsa_reused": [
            [
              21306417,
              21165791,
              20383208,
              21211459,
              21120292
            ],
            [
              22262916,
              21085750,
              21748917,
              21054125,
              22288333
            ],
            [
              21523458,
              21172417,
              20404625,
              21127125,
              20933000
            ],
            [
              21391917,
              21373125,
              21579166,
              21580042,
              21090000
            ],
            [
              22072125,
              21804083,
              21921333,
              21869125,
              21802542
            ],
            [
              21932458,
              21329167,
              21648084,
              21252792,
              21535042
            ],
            [
              21884958,
              21904916,
              22373834,
              22028417,
              21617459
            ],
            [
              21689334,
              21584500,
              21377792,
              21105292,
              21029500
            ],
            [
              21097958,
              21772791,
              21808625,
              21671875,
              21633333
            ],
            [
              28817417,
              28444667,
              28251583,
              28329792,
              28366791
            ],
            [
              30338583,
              30285042,
              31346458,
              30848958,
              31760750
            ],
            [
              34250708,
              32908875,
              37274541,
              34728750,
              35091042
            ],
            [
              39289875,
              41466000,
              43343583,
              51758917,
              47389833
            ],
            [
              21565625,
              21052625,
              20944125,
              20835708,
              21068542
            ],
            [
              21906292,
              21793834,
              21268250,
              21555583,
              22635333
            ],
            [
              24026625,
              23675458,
              23745500,
              23501083,
              23549292
            ],
            [
              21590833,
              21516375,
              21201250,
              22989250,
              23319625
            ],
            [
              23147667,
              22936042,
              22764084,
              22969833,
              23557000
            ],
            [
              21719834,
              21763541,
              21468250,
              21304916,
              22204125
            ],
            [
              29070000,
              28903167,
              28540208,
              28221334,
              28408250
            ],
            [
              22146292,
              21654625,
              21649583,
              22059500,
              21818834
            ]
          ],
          "morgan_reused": [
            [
              433585292,
              451702333,
              442392375,
              463166167,
              470946666
            ],
            [
              456262125,
              479890584,
              470584541,
              457766458,
              462177834
            ],
            [
              446281750,
              443054875,
              444868917,
              493645792,
              451681125
            ],
            [
              451943625,
              447403209,
              448016250,
              444703250,
              451402625
            ],
            [
              451318625,
              499492292,
              540842834,
              465383500,
              458901875
            ],
            [
              463695417,
              437929875,
              434241792,
              460802458,
              467156041
            ],
            [
              447291416,
              447107667,
              445100500,
              485877084,
              451189542
            ],
            [
              462767583,
              443190042,
              479755083,
              541614042,
              520925375
            ],
            [
              442901959,
              471403458,
              471704167,
              461033417,
              451704458
            ],
            [
              442561000,
              818793417,
              1449095500,
              1264978375,
              909868333
            ],
            [
              651844125,
              640597500,
              640729084,
              617511042,
              1219269083
            ],
            [
              887006416,
              810130083,
              800369000,
              1004462333,
              809219250
            ],
            [
              642431709,
              579525625,
              588380667,
              580258125,
              489392208
            ],
            [
              454961708,
              445085750,
              439630917,
              446484125,
              456941625
            ],
            [
              452690500,
              449476208,
              462934000,
              472272875,
              483734084
            ],
            [
              460978292,
              448963958,
              466097500,
              446218875,
              448033625
            ],
            [
              459464292,
              468232958,
              478371333,
              489012417,
              465717084
            ],
            [
              464877375,
              456646000,
              450742292,
              457668459,
              452654250
            ],
            [
              453854833,
              540009625,
              595930750,
              683712292,
              683629333
            ],
            [
              673509541,
              678926041,
              674907291,
              620025875,
              603614542
            ],
            [
              453804125,
              458353000,
              436765167,
              457898875,
              495360417
            ]
          ]
        }
      }
    }
  ]
}
