path: root/pyrrolizidine-alkaloids/tensorflow/pred.lr2.v5-ext-Padel-2D.csv

name,pred
9415,0.19038539143860198
5281743,0.5883577161773279
73614,0.0680991227361327
119040,0.20510647179559227
280564,0.0472620520972806
5280906,0.5403136802232874
5281733,0.5403136802232874
5281734,0.41757043906954927
5281744,0.5481055519670106
5281756,0.5883577161773279
5380876,0.554534323013647
21606566,0.10307448681036072
613201,0.14726437598796432
5281750,0.43351852554864895
5355258,0.09385454085249155
9341,0.1077940630567862
10198,0.30086071209832155
577603,0.7699360524251709
99322,0.374307223009136
185716,0.3763814225168418
442726,0.37246403969724334
5281753,0.0962378304762505
5281754,0.0962378304762505
6269253,0.09490332867498111
6440301,0.24842150687236947
6440889,0.6096112275839296
6441178,0.3257374868354314
12308873,0.9251817715448626
15120074,0.46097353232947186
15736564,0.6506744957255068
76957522,0.30849612768960144
98222,0.1791108695766248
197173,0.1005671850249176
259727,0.1817966957160281
268949,0.1208049342615174
279070,0.6394234336834528
323256,0.0675348120814629
333106,0.03320698630892426
333468,0.09400436637757185
333469,0.08734204002119333
340066,0.0472620520972806
341142,0.10225396046715739
357033,0.020475555318453218
357034,0.024992126129902145
5281729,0.11461890174590744
5458800,0.05573330638876684
6438237,0.43351852554864895
6440654,0.0867964206054851
6604611,0.5883577161773279
10569934,0.2038172585912021
21771304,0.036501249898678256
44284782,0.0049261698423624925
44284870,0.060762276013809194
44374459,0.08744759805176062
44374601,0.12157788166653795
44559289,0.0874209831958038
71449185,0.041408394233193174
71449186,0.038222216112535165
71458133,0.007467830555126681
76313095,0.055592271195525955
76315880,0.21202987073121585
76330453,0.681746938129656
76334042,0.04461235631496609
59827875,0.3963848776849857
91554673,0.3963848776849857
31745,0.5481055519670106
33555,0.03434893137614779
43040,0.1840697933839805
72614,0.731757880607879
107939,0.554534323013647
119052,0.7342398609916334
119390,0.05573330638876684
148316,0.0315921424341607
148317,0.018517777646804272
148318,0.04163749068878898
148326,0.041616434502366836
153499,0.2478397357604654
156006,0.06258426652458028
156038,0.058748441129174406
156169,0.29239298294692595
156170,0.21683392222152528
156778,0.0878257404243846
157017,0.086947744250456
158192,0.7594804658798409
162662,0.52292235765635
165417,0.2541055777352027
165551,0.10110856958328458
167211,0.2869426283450355
169196,0.12801679126024024
169779,0.18887074410052182
179107,0.2652831029357521
180203,0.2626192438119864
180509,0.07778040944407595
181267,0.7366597951046565
181871,0.39908433542320576
181990,0.4170679627113851
182761,0.08828666313225081
186182,0.19624483179941732
186973,0.2255925847886198
186974,0.14036519458217855
186977,0.10854743036776111
186980,0.04932336925406228
187805,0.019994618406784043
188435,0.28225771749902734
189677,0.2489487669724307
190233,0.26162109047428544
213104,0.1208049342615174
427386,0.12172904148903843
427628,0.08286907715165993
427631,0.07551153998751338
427636,0.14174340949321498
428743,0.033108875122447895
442740,0.10246865834464229
442742,0.14726437598796432
494923,0.09490332867498111
522876,0.2315461371533045
610955,0.002844696618900691
636922,0.09938975150922369
638871,0.1084231608345286
638872,0.17967715808630258
3033169,0.0707582907786002
3038510,0.18051798824500911
3080172,0.042219480629116284
3085052,0.09623045018418241
3086069,0.03253101709311702
3360000,0.30196625455636084
5036864,0.5938812311754684
5134178,0.06757372468667781
5255771,0.19634012000664364
5281721,0.2020604477039696
5318830,0.17967715808630258
5319875,0.19038539143860198
5319976,0.0962378304762505
5320165,0.4770195169922122
5321160,0.2626197689308648
5368830,0.2484418403762191
5379437,0.28178641573432595
5566367,0.43351852554864895
5969895,0.5481055519670106
6104648,0.554534323013647
6254547,0.5938812311754684
6351912,0.14726437598796432
6429351,0.48056059478531643
6429352,0.15459127117305604
6429354,0.08046368721662066
6429355,0.13395707652896727
6429356,0.2538365287867259
6431047,0.1180769226381994
6431048,0.10925028328779465
6433648,0.41757043906954927
6433995,0.30849612768960144
6437833,0.22705395979668136
6437851,0.35553001495381115
6440495,0.06088578164882909
6440559,0.20962005784832216
6440796,0.2315461371533045
6440923,0.8837970992304429
6441608,0.09345835300337396
6442429,0.11671133071104924
6442556,0.11901911965266457
6442559,0.28178641573432595
6442619,0.355829841332993
6443105,0.20991360494910538
6556553,0.20510647179559227
6708770,0.6745000371412974
7082455,0.43351852554864895
7224673,0.5938812311754684
7457361,0.06690684445966287
9548770,0.5624854311794519
9975102,0.26248510104754724
10023607,0.05107791485255624
10095536,0.03677923585333531
10251171,0.037499095221568794
10253491,0.03688410075495088
10412383,0.015842562922228607
10548599,0.22165040209266412
10569935,0.23682120907860438
10572157,0.30770637865560513
10577975,0.39579493086589784
10597940,0.24014305749097797
10639512,0.20219356491193086
10696910,0.04515199702716103
10710914,0.20219356491193086
10719345,0.04195665855548799
10759513,0.278030438832683
10838897,0.43281025298098585
10938567,0.04462294735899004
10939203,0.013652871762895698
10991752,0.048856090520623084
10992912,0.4400569272267909
10996028,0.003575370753791802
11008580,0.3542102460398322
11011039,0.018541567840651058
11014516,0.006562924583277717
11058357,0.47459132220401734
11068907,0.4958096906841303
11241297,0.13579125429430053
11436705,0.2844784333905854
11522514,0.06119665858952609
11594349,0.369441817570664
11618501,0.03577644779882092
11811349,0.47459132220401734
11827237,0.028440111061945494
11827238,0.0549032573686401
12085704,0.042798651584089874
12085705,0.13073065531393277
12085706,0.05001364138115893
12299896,0.5403136802232874
12308839,0.11461890174590744
13195112,0.2020604477039696
13258912,0.355829841332993
14313395,0.09490332867498111
14313398,0.17967715808630258
14589301,0.10568239554311212
14680172,0.0554533637225909
14825842,0.6361984543918525
14845641,0.06978797520616492
14845643,0.04679429799254462
15060933,0.058748441129174406
15060936,0.09218724669175238
15240755,0.05839371222643865
15286355,0.15531540605324867
15286357,0.15029293995695017
15286358,0.1644421322006382
15558714,0.4516679001877246
15559784,0.18051798824500911
15765644,0.1180769226381994
15765645,0.15711258813014362
15967910,0.18041477637220718
16687858,0.00013708112498573115
20056157,0.1005671850249176
20056173,0.4164017483467914
20106090,0.044592521646284786
20839516,0.6096112275839296
21124823,0.07454240970223228
21586628,0.14922528558213427
21586631,0.20962005784832216
21606568,0.10948033298847404
21671366,0.3234545966500147
21671448,0.14209951525112424
21762186,0.3700841625853718
21762187,0.46546484230811586
21762188,0.19555268638110382
21762361,0.15017240211587168
21762363,0.12774642502455522
23305243,0.8837970992304429
23305253,0.3257374868354314
23350898,0.5624854311794519
23968120,0.022220621564036376
26879145,0.033108875122447895
38364109,0.11966512532424003
44374956,0.09315446539024037
53462637,0.086947744250456
56776345,0.2062302938231831
71358863,0.15075438074313757
71440312,0.06096096267093256
72701752,0.05935693311405896
72702799,0.0394781648976416
72702800,0.023049705453861917
73759932,0.21489186781868283
73893110,0.28317474554988853
73893120,0.37355635200507886
73893122,0.0766566978165522
73893125,0.2858296295541083
78358487,0.41830580360941333
91735634,0.34525336012546815
91746708,0.7594804658798409
91746994,0.9777357295257558
91746995,0.8420503803763627
91746999,0.9251817715448626
91747008,0.07775224615437593
91747009,0.6675286152402455
91747010,0.27347744424580617
91747011,0.09899276944148944
91747348,0.045430586422794406
91747349,0.3647330552097898
91747351,0.0432807306162787
91747352,0.028454442706000425
91747355,0.0716871392492906
91747358,0.25786661161363184
91747359,0.25786661161363184
91747605,0.005654794150211807
91747606,0.005645033869339472
91747608,0.0070707165070745415
91747609,0.008744183421359243
91747611,0.008744183421359243
91748008,0.11723917710782654
91748009,0.14896200526136077
91748011,0.278030438832683
91748012,0.20219356491193086
91749686,0.20766710895025609
91749687,0.7010794923745653
91749688,0.1304556602690582
91749690,0.08559699427817369
91749691,0.29356305873635746
91749692,0.10301260756885805
91751310,0.081321877110204
91751311,0.07644750851537785
91751312,0.06956950687881958
91751313,0.05993857767213079
91751314,0.03190531417889414
91751316,0.04338004411562481
91751437,0.15711258813014362
91752775,0.9133323363102696
91752874,0.11428817217399273
91752876,0.30145421630419844
91752877,0.10724042147549272
91753270,0.19591517315025408
91753274,0.5976403377547063
91753673,0.22959609402114695
92167309,0.25344890435187895
92170778,0.09385454085249155
92240481,0.0680991227361327
92245581,0.0472620520972806
92245583,0.0472620520972806
92245889,0.1005671850249176
92245890,0.1005671850249176
92245891,0.1005671850249176
92245892,0.1005671850249176
92254804,0.05573330638876684
92258314,0.08286907715165993
92258315,0.08286907715165993
92258316,0.08286907715165993
92258317,0.08286907715165993
92258329,0.14174340949321498
94908779,0.6394234336834528
100854393,0.2062302938231831
100925967,0.4958096906841303
100979629,0.18442461792380777
100979630,0.015712469827467532
100979631,0.021176561787121843
101134822,0.5445936381657706
101244775,0.10968484210080608
101244776,0.17018068657239288
101286187,0.5203418145404451
101288094,0.33002336946515165
101289784,0.3799490547339497
101339003,0.11461890174590744
101339004,0.0394781648976416
101339005,0.02400550020808781
101339006,0.06088578164882909
101360987,0.07531482627400753
101526911,0.5862846005091529
101602684,0.07530123252046057
101605596,0.0792627446482701
101609673,0.06088578164882909
101609674,0.10132525843863044
101613210,0.07356289988326453
101613211,0.021040369094655547
101616166,0.02939714474946963
101635998,0.4896451870184577
101648301,0.002844696618900691
101664189,0.03764042453884356
101674026,0.07418292859668806
101674027,0.07460274687668446
101696510,0.06710020469714141
101705400,0.34889992151270643
101705715,0.2315461371533045
101779180,0.39313560602959313
101915797,0.028448746422272818
101915798,0.07378684735704015
101915799,0.015842562922228607
101949642,0.42886915353281924
102004942,0.20037591361950535
102064908,0.03882054094659689
102090418,0.33239170603808815
102092537,0.23682120907860438
102115589,0.21216809282948265
102115628,0.17540255354721063
102122201,0.025231108858578634
102144111,0.3564924051043972
102207572,0.05555635771430045
102228697,0.023049705453861917
102228698,0.0394781648976416
102228699,0.05935693311405896
102445396,0.7792201729601067
102478913,0.15460378227044913
102588230,0.29569430249557527
118701696,0.058748441129174406
5380224,0.05424658816316913
442706,0.03372815739327676
32319,0.036601152091194175
158633,0.03417199884231873
190040,0.02993049311184075
5352405,0.42699109926806816
11723103,0.06172027697143866
91747534,0.43223914847317096
91747615,0.0038567219554666745
101044824,0.07126638857421488
101044825,0.0663637683643633
5281720,0.6522464175678735
5459074,0.22624753951511858
5281752,0.6139095052886406
5284440,0.8114489724691377
5281740,0.6126352577824595
6441254,0.8984631001793835
22310115,0.443844865207571
12041879,0.7969580476236466
44559774,0.778713247375455
59827871,0.8019093926396402
119243,0.8114489724691377
526538,0.5813933382150159
3713463,0.5662435937387628
4095226,0.19650612090734856
5281726,0.7790908100022302
5284370,0.4204447251560482
6324941,0.4204447251560482
6428023,0.5813933382150159
6440206,0.7860716845269642
6440207,0.5813933382150159
6440919,0.5523761461238267
6440920,0.5813933382150159
6440921,0.7860716845269642
6441405,0.443844865207571
6442432,0.808497341587537
10880125,0.6269967391661754
11111309,0.22369914490305598
12304138,0.23821577164382182
14313730,0.4662069351495349
21606532,0.41808837523107284
21627985,0.443844865207571
89233061,0.6060413091848275
91746989,0.7860716845269642
91747000,0.19356304246450395
91747001,0.443844865207571
91753267,0.5110620322106632
91753269,0.5766715621110612
91753273,0.6139095052886406
91753275,0.31617809696309085
100925969,0.5169564605664481
101057317,0.41808837523107284
101096098,0.4204447251560482
101297578,0.4412714077457273
101360988,0.5813933382150159
101543954,0.60947186216892
102059844,0.5662435937387628
102496937,0.32340032170254107
102502161,0.6475921286730427
104764,0.2019906009461825
5281742,0.41705730258685464
5281746,0.22688027130528327
5281748,0.5870219908959995
6440870,0.582418541858987
6441180,0.7482291041745056
168571,0.5798414524910402
355833,0.03825380345491108
5799962,0.1505462582951968
38350,0.34529302024915953
148320,0.01806891790214681
148321,0.00622406379982764
148322,0.20699928114417496
151347,0.020092405626917834
151555,0.2970762984908897
156034,0.27349149578049525
162396,0.3935302739985379
178760,0.23672788738827893
188434,0.1738444976402455
194088,0.3980430619924593
232738,0.1505462582951968
382065,0.22688027130528327
419279,0.022105966678106753
442746,0.33527444872622625
442749,0.10724782717859022
496831,0.07831781245278148
526539,0.1738444976402455
4484072,0.5870219908959995
4484073,0.29432178513346563
5232043,0.3647066367818688
5281722,0.41816172523978923
5281745,0.4891754275528337
5281749,0.29432178513346563
5320938,0.17662984938903467
5321137,0.22688027130528327
5352420,0.22688027130528327
5916866,0.4891754275528337
6124067,0.5870219908959995
6428018,0.247056501842844
6428020,0.14613430511477268
6428026,0.14613430511477268
6428030,0.22688027130528327
6429060,0.1947612001878274
6429061,0.09111481648877866
6429062,0.1947612001878274
6429063,0.09111481648877866
6440039,0.04909326130373817
6441496,0.5553884323025936
6442293,0.7106234281040521
6442685,0.18295765382414303
6442687,0.18295765382414303
6445133,0.11665033529665332
6912281,0.41705730258685464
10086314,0.10202329062265024
10344513,0.020733339647285524
10433214,0.31518354904858353
10497165,0.1738444976402455
10502318,0.3681641943782005
10572291,0.13656283599411803
10717096,0.26651451057379777
10738499,0.07770008282514622
10739462,0.07491398483619502
10787656,0.2359560916303829
11233017,0.05010558665359125
11303112,0.019801996400926367
11369281,0.18199025522882514
14287858,0.5155767665656809
14589311,0.006320377884112529
14589313,0.06387624773772184
14659818,0.1505462582951968
16082455,0.11961243720934778
21144858,0.49580654955759457
21581303,0.052810491629507475
21626760,0.11184336203173686
21670206,0.09854549176956713
22524559,0.41816172523978923
23305279,0.7106234281040521
44148183,0.18295765382414303
46861355,0.3038914376730696
51413602,0.3752290046002435
52340564,0.10954346051416262
52340565,0.3038914376730696
68380175,0.5331998965767961
74934296,0.18295765382414303
91746536,0.2918410918116065
91746606,0.2170707968221675
91747012,0.10724782717859022
91747610,0.007399313623738246
91747612,0.007399313623738246
91747938,0.12014984818834572
91747943,0.2643859190146379
91749424,0.01995059157430331
91749426,0.02893699254566687
91749427,0.017993123527746322
91749428,0.010534927578385306
91749429,0.01630201735647039
91749431,0.056795560339165156
91749432,0.016270513071187105
91749433,0.09821646939297456
91749434,0.07061419492628244
91749435,0.050891131669730194
91749436,0.04689864147253713
91749439,0.12800184749443067
91749440,0.18423213396775595
91749448,0.010534927578385306
91749449,0.08185342445063014
91749454,0.05432016103335894
91749889,0.10320510153211962
91749890,0.13725155980131323
91753677,0.1585401738893005
91991897,0.15139033153220455
92019195,0.16952708598424707
92233018,0.1505462582951968
92246526,0.022105966678106753
92263445,0.1505462582951968
92263446,0.4891754275528337
93504569,0.464734128497263
98567771,0.1505462582951968
100916220,0.07770008282514622
100976533,0.1738444976402455
101297661,0.25739972791267357
101324857,0.23055243941574335
101360989,0.4019674724720651
101526912,0.7272042862074181
101689715,0.36354226345127344
101793685,0.1658107587952842
101992452,0.16827112126958782
102207684,0.09821646939297456
102207687,0.18423213396775595
102372765,0.1340766276005813
102372767,0.0950103409900675
102442056,0.1753151990016972
102442057,0.3140192707783265
102588231,0.03701218416669441
102596225,0.09302373603309891
102596226,0.01539057243971072
6440436,0.1084907445263995
656392,0.05432270444833739
10806120,0.05772579209848386
10523,0.017078509816406327
26477,0.019328996480765994
155104,0.023526717858629396
155153,0.019328996480765994
169554,0.11809084899572893
4483893,0.07925956210431541
5315247,0.01769144789552433
10685701,0.017966176062405033
13967757,0.29354872253462677
46930232,0.04477547990061905
51693704,0.07358286019197456
67189194,0.07799763036527968
91747354,0.11787312527741374
91747604,0.022389051764640268
91747607,0.022389051764640268
91749893,0.1701663546901513
91749894,0.11787312527741374
91749895,0.0336778148341015
91749896,0.04967423381328663
91749897,0.15807621309480993
91749898,0.11041935153934894
91749899,0.1734341590075676
101324794,0.11834154265388201
101360427,0.4533701094647665
118701599,0.07925956210431541