Merge pull request #126 from samplchallenges/submission_correction

logP Submission correction
samplchallenges · Dec 21, 2020 · d11f2ae · d11f2ae
2 parents 948a366 + 9b053d6
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diff --git a/physical_property/logP/analysis/SAMPL7-user-map-logP.csv b/physical_property/logP/analysis/SAMPL7-user-map-logP.csv
@@ -1,6 +1,6 @@
 21,logP-dddc-1.csv
 23,logP-dddc-2.csv
-25,logP-JudithWarnauDassaultSystemes.csv
+25,logP-JudithWarnau3DS_resubmission.csv
 26,logP-ChrisLoschen-1.csv
 27,logP-ChrisLoschen-2.csv
 28,logP-FabioFalcioni-1.csv

diff --git a/...l_property/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/COSMO-RS.pdf b/...l_property/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/COSMO-RS.pdf
diff --git a/...l_property/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/Chemprop.pdf b/...l_property/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/Chemprop.pdf
diff --git a/...ty/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/ClassicalGSG_DB1.pdf b/...ty/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/ClassicalGSG_DB1.pdf
diff --git a/...ty/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/ClassicalGSG_DB2.pdf b/...ty/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/ClassicalGSG_DB2.pdf
diff --git a/...ty/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/ClassicalGSG_DB3.pdf b/...ty/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/ClassicalGSG_DB3.pdf
diff --git a/...ty/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/ClassicalGSG_DB4.pdf b/...ty/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/ClassicalGSG_DB4.pdf
diff --git a/...roperty/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/EC_RISM_wet.pdf b/...roperty/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/EC_RISM_wet.pdf
diff --git a/...gP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/Ensemble_EPI_physprop.pdf b/...gP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/Ensemble_EPI_physprop.pdf
diff --git a/...rty/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/Ensemble_Martel.pdf b/...rty/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/Ensemble_Martel.pdf
diff --git a/...cal_property/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/GROVER.pdf b/...cal_property/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/GROVER.pdf
diff --git a/.../analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/MD-EE-MCC_GAFF-TIP4P-Ew.pdf b/.../analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/MD-EE-MCC_GAFF-TIP4P-Ew.pdf
diff --git a/...rty/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/MD_CGenFF_TIP3P.pdf b/...rty/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/MD_CGenFF_TIP3P.pdf
diff --git a/...perty/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/MD_GAFF_TIP3P.pdf b/...perty/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/MD_GAFF_TIP3P.pdf
diff --git a/...alysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/MD_LigParGen_OPLS-AA_TIP4P.pdf b/...alysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/MD_LigParGen_OPLS-AA_TIP4P.pdf
diff --git a/...ty/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/MD_OPLS-AA_TIP4P.pdf b/...ty/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/MD_OPLS-AA_TIP4P.pdf
diff --git a/.../logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/NES-1_GAFF2_OPC3_B.pdf b/.../logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/NES-1_GAFF2_OPC3_B.pdf
diff --git a/.../logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/NES-1_GAFF2_OPC3_G.pdf b/.../logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/NES-1_GAFF2_OPC3_G.pdf
diff --git a/.../logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/NES-1_GAFF2_OPC3_J.pdf b/.../logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/NES-1_GAFF2_OPC3_J.pdf
diff --git a/...ogP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/NULL0_mean_clogP_FDA.pdf b/...ogP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/NULL0_mean_clogP_FDA.pdf
diff --git a/...alysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/QSPR_Mordred2D_TPOT_AutoML.pdf b/...alysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/QSPR_Mordred2D_TPOT_AutoML.pdf
diff --git a/...perty/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/REF1_ChemAxon.pdf b/...perty/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/REF1_ChemAxon.pdf
diff --git a/...rty/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/TFE-NHLBI-NN-IN.pdf b/...rty/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/TFE-NHLBI-NN-IN.pdf
diff --git a/...y/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/TFE-NHLBI-TZVP-QM.pdf b/...y/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/TFE-NHLBI-TZVP-QM.pdf
diff --git a/...logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/TFE-SM12-vacuum-opt.pdf b/...logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/TFE-SM12-vacuum-opt.pdf
diff --git a/...logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/TFE-SM8-solvent-opt.pdf b/...logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/TFE-SM8-solvent-opt.pdf
diff --git a/.../logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/TFE-SM8-vacuum-opt.pdf b/.../logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/TFE-SM8-vacuum-opt.pdf
diff --git a/...logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/TFE-SMD-solvent-opt.pdf b/...logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/TFE-SMD-solvent-opt.pdf
diff --git a/.../logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/TFE-SMD-vacuum-opt.pdf b/.../logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/TFE-SMD-vacuum-opt.pdf
diff --git a/...ty/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/TFE_Attentive_FP.pdf b/...ty/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/TFE_Attentive_FP.pdf
diff --git a/...erty/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/TFE_IEFPCM_MST.pdf b/...erty/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/TFE_IEFPCM_MST.pdf
diff --git a/...alysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/TFE_MD_neat_oct_GAFF_TIP4P.pdf b/...alysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/TFE_MD_neat_oct_GAFF_TIP4P.pdf
diff --git a/...al_property/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/TFE_MLR.pdf b/...al_property/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/TFE_MLR.pdf
diff --git a/...roperty/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/TFE_b3lypd3.pdf b/...roperty/logP/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/TFE_b3lypd3.pdf
diff --git a/...P/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/TFE_wet_oct_GAFF_TIP4P.pdf b/...P/analysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/TFE_wet_oct_GAFF_TIP4P.pdf
diff --git a/...alysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/ffsampled_deeplearning_cl1.pdf b/...alysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/ffsampled_deeplearning_cl1.pdf
diff --git a/...alysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/ffsampled_deeplearning_cl2.pdf b/...alysis/analysis_outputs_all_submissions/AbsoluteErrorPlots/ffsampled_deeplearning_cl2.pdf
diff --git a/...s_outputs_all_submissions/MolecularStatisticsTables/Empirical/MAE_vs_molecule_ID_plot.pdf b/...s_outputs_all_submissions/MolecularStatisticsTables/Empirical/MAE_vs_molecule_ID_plot.pdf
diff --git a/..._outputs_all_submissions/MolecularStatisticsTables/Empirical/RMSE_vs_molecule_ID_plot.pdf b/..._outputs_all_submissions/MolecularStatisticsTables/Empirical/RMSE_vs_molecule_ID_plot.pdf
diff --git a/.../MolecularStatisticsTables/Empirical/molecular_error_statistics_for_Empirical_methods.csv b/.../MolecularStatisticsTables/Empirical/molecular_error_statistics_for_Empirical_methods.csv
@@ -1,23 +1,23 @@
 ,Molecule ID,MAE,MAE_lower_CI,MAE_upper_CI,RMSE,RMSE_lower_CI,RMSE_upper_CI
-1,SM26,0.7188235294117648,0.31882352941176473,1.1876470588235295,1.1644589756115726,0.5785987129161586,1.614691738928736
-13,SM38,0.8458823529411764,0.4558823529411765,1.2858823529411765,1.226889898698906,0.7267494106515346,1.6619938415685438
-19,SM44,0.8629411764705882,0.5588235294117647,1.2094117647058822,1.1075489631986266,0.7026295149608487,1.4477832954514414
-4,SM29,0.9329411764705884,0.501764705882353,1.4076470588235297,1.3417021673539749,0.7791397971669859,1.7875780525945286
-10,SM35,0.9588235294117647,0.6064705882352941,1.3411764705882354,1.2303179885465287,0.7711908286005786,1.6334175648548874
-3,SM28,0.974705882352941,0.5323529411764705,1.4929411764705882,1.4069219636371826,0.7748813950990102,1.962137190142722
-2,SM27,0.9964705882352942,0.49352941176470594,1.5641176470588238,1.5211257441157733,0.7968799451980352,2.1177318610471247
-14,SM39,1.0935294117647059,0.44588235294117645,1.872941176470588,1.8394804253631287,0.8483998779709817,2.5733567000869417
-6,SM31,1.156470588235294,0.5394117647058824,1.8611764705882354,1.7964049065384158,0.8795587128849128,2.5300244128094427
-21,SM46,1.1758823529411764,0.7488235294117647,1.6605882352941177,1.52158779298623,0.938521991970228,2.0135584538470255
-12,SM37,1.1811764705882353,0.6435294117647059,1.8200000000000003,1.7066134336060717,0.948131288997716,2.4145466021838646
-20,SM45,1.2511764705882353,0.5370588235294117,2.100588235294117,2.0851985375921567,1.014903646542225,2.921284971096271
-7,SM32,1.2547058823529411,0.6100000000000001,1.9805882352941173,1.9297287221722306,1.054943544628309,2.5903281645382306
-0,SM25,1.3094117647058825,0.5011764705882353,2.260588235294118,2.295788983949424,1.0579641937675006,3.2036091778969986
-16,SM41,1.3141176470588236,1.043529411764706,1.605294117647059,1.4394443372357264,1.1229058941241796,1.735655495770978
-5,SM30,1.324705882352941,0.4570588235294118,2.3588235294117643,2.3738377961337083,1.1184705944226854,3.3084899701152097
-15,SM40,1.3976470588235295,0.8894117647058825,1.9911764705882353,1.8182926704175315,1.0853814726521136,2.4726099571100977
-18,SM43,1.4358823529411764,1.0752941176470587,1.828823529411765,1.641145582673704,1.2196744985252996,2.0541450203687863
-9,SM34,1.5147058823529411,0.7147058823529412,2.443529411764706,2.3752931707599427,1.2200554471488776,3.26752289698985
-8,SM33,1.661764705882353,0.7688235294117647,2.7658823529411762,2.6503418203518354,1.3301835344395592,3.688123227493419
-11,SM36,1.7288235294117646,1.362941176470588,2.0958823529411768,1.8918074146481314,1.5109093483142957,2.2526676995744137
-17,SM42,1.9052941176470588,1.329411764705882,2.5617647058823527,2.3086474267796873,1.5481620982161206,2.9912450683325043
+1,SM26,0.7475,0.33875,1.2312500000000002,1.1985355647622644,0.6680194607943694,1.6573208802160189
+13,SM38,0.819375,0.398125,1.2862500000000001,1.2241451098623888,0.6784264882800494,1.6846958182413823
+19,SM44,0.88,0.5474999999999999,1.244375,1.1320666941483615,0.7076899038420712,1.4779736973302333
+10,SM35,0.9368750000000001,0.5793750000000001,1.350625,1.2251658051055783,0.7445846157422271,1.6536852784009415
+4,SM29,0.9381250000000001,0.481875,1.4387500000000002,1.3665718971206748,0.7749758060739703,1.8266567822116995
+3,SM28,0.968125,0.5081249999999999,1.521875,1.4248662217906634,0.7612653939330226,2.004797371307135
+2,SM27,1.013125,0.48250000000000004,1.6350000000000002,1.5572832915047923,0.8092743663307272,2.1792860069297926
+12,SM37,1.145625,0.57625,1.836875,1.7038650914905205,0.8820041099677484,2.446606067596498
+14,SM39,1.156875,0.48437500000000006,1.9568750000000001,1.895987539516017,0.9622889378975528,2.648749705049535
+6,SM31,1.161875,0.52625,1.9137500000000003,1.8322680617202276,0.8848093014881794,2.584477703521545
+21,SM46,1.185625,0.73375,1.7068750000000001,1.5475484645076547,0.9425795722378031,2.0672626828731757
+7,SM32,1.264375,0.575,2.0625,1.9700174491613012,1.0552428630414894,2.67652409852779
+20,SM45,1.3243749999999999,0.5568749999999999,2.1868749999999997,2.1492804028325385,1.029195681102481,2.9970370785160463
+16,SM41,1.356875,1.0875,1.6524999999999999,1.4753622436540796,1.1620940151295849,1.7783050216428002
+15,SM40,1.36375,0.839375,1.9912500000000002,1.810414317221337,1.0191203314623845,2.501061024845255
+0,SM25,1.3756249999999999,0.5225,2.38875,2.3656196334153132,1.1482677170416313,3.3054613898819025
+5,SM30,1.404375,0.50125,2.4368749999999997,2.4468640644710935,1.1793615857742694,3.3843361609036418
+18,SM43,1.495625,1.13375,1.8987500000000002,1.6873925891741968,1.2642809221055265,2.1226501713659744
+9,SM34,1.524375,0.6725000000000001,2.51,2.424673947152483,1.2060576271472272,3.3394498049828507
+8,SM33,1.7381250000000001,0.7975,2.8362499999999997,2.7296943510217404,1.3742588911846267,3.7518120621907487
+11,SM36,1.783125,1.40875,2.16625,1.9381418291755637,1.5579453616863461,2.3107506897110297
+17,SM42,1.930625,1.3256249999999998,2.61625,2.3499667550839947,1.5500282255494575,3.050949647241003
diff --git a/...is/analysis_outputs_all_submissions/MolecularStatisticsTables/MAE_vs_molecule_ID_plot.pdf b/...is/analysis_outputs_all_submissions/MolecularStatisticsTables/MAE_vs_molecule_ID_plot.pdf
diff --git a/...outputs_all_submissions/MolecularStatisticsTables/Physical_MM/MAE_vs_molecule_ID_plot.pdf b/...outputs_all_submissions/MolecularStatisticsTables/Physical_MM/MAE_vs_molecule_ID_plot.pdf
diff --git a/...utputs_all_submissions/MolecularStatisticsTables/Physical_MM/RMSE_vs_molecule_ID_plot.pdf b/...utputs_all_submissions/MolecularStatisticsTables/Physical_MM/RMSE_vs_molecule_ID_plot.pdf
diff --git a/...ecularStatisticsTables/Physical_MM/molecular_error_statistics_for_Physical_MM_methods.csv b/...ecularStatisticsTables/Physical_MM/molecular_error_statistics_for_Physical_MM_methods.csv
@@ -1,23 +1,23 @@
 ,Molecule ID,MAE,MAE_lower_CI,MAE_upper_CI,RMSE,RMSE_lower_CI,RMSE_upper_CI
-3,SM28,0.727,0.398,1.105,0.9284772479711066,0.5074938423271755,1.3254584112675885
-2,SM27,0.749,0.325,1.3460000000000003,1.134076716981704,0.4028647415696738,1.7941878385497991
-4,SM29,0.7929999999999999,0.381,1.435,1.2078037920125932,0.44989998888641897,1.9466869291182902
-1,SM26,0.8069999999999998,0.495,1.126,0.954122633627355,0.6392026282799532,1.2161455504996104
-15,SM40,0.9309999999999998,0.626,1.23,1.0522119558339946,0.7454528824815154,1.3057871189439725
-6,SM31,0.9780000000000001,0.5810000000000001,1.3860000000000001,1.1716569463797841,0.7269456650947167,1.5387657391558989
-12,SM37,1.0219999999999998,0.5,1.636,1.3859870129261673,0.5952478475391575,1.9904220657940865
-5,SM30,1.0699999999999998,0.5999999999999999,1.6760000000000002,1.3828810505607487,0.7088723439378913,2.036013261253472
-0,SM25,1.07,0.7100000000000002,1.4260000000000002,1.2163305471786854,0.8607090100608917,1.5324131296748928
-7,SM32,1.097,0.6520000000000001,1.5819999999999999,1.3332104110004541,0.7983921342297907,1.7703558964230892
-14,SM39,1.116,0.708,1.5190000000000001,1.296240718385285,0.889449267805646,1.6159207901379324
-10,SM35,1.16,0.6779999999999998,1.8490000000000002,1.5276779765382493,0.7751580484004537,2.319094650936007
-19,SM44,1.307,0.8150000000000001,1.989,1.6417216572854245,0.9084602357836034,2.4243081487302724
-9,SM34,1.434,0.852,2.0589999999999997,1.7410916116046278,1.066339533169431,2.274440590562875
-20,SM45,1.545,1.112,2.0870000000000006,1.7332830120900626,1.1330666352867338,2.3078604810516605
-13,SM38,1.5550000000000002,0.9299999999999999,2.2479999999999998,1.8788214390941997,1.1509517800498854,2.552118727645718
-11,SM36,1.614,0.9380000000000001,2.2670000000000003,1.9535762078813308,1.3229928193304752,2.4365344241360516
-8,SM33,1.6260000000000001,1.28,1.9760000000000002,1.720941602727995,1.3573393090896617,2.0496975386627168
-21,SM46,1.6949999999999998,1.239,2.2150000000000003,1.864534794526506,1.3470857433734498,2.383740757716745
-16,SM41,2.021,1.799,2.263,2.056110405595964,1.8192031222488598,2.2973180014965275
-17,SM42,2.4,1.834,3.0130000000000003,2.5871915275062265,1.9288027374513963,3.196172711228228
-18,SM43,2.906,2.478,3.3560000000000008,2.9908293164271345,2.5370750875762424,3.4289050730517463
+3,SM28,0.727,0.40599999999999997,1.107,0.9284772479711066,0.5158778925288425,1.3247943236593367
+2,SM27,0.749,0.33199999999999996,1.339,1.134076716981704,0.40842379950242863,1.78826172581085
+4,SM29,0.7929999999999999,0.375,1.426,1.2078037920125932,0.44819638552759433,1.9461371996855719
+1,SM26,0.8069999999999998,0.49399999999999994,1.1249999999999998,0.954122633627355,0.640257760593341,1.216351100628433
+15,SM40,0.9309999999999998,0.6249999999999999,1.233,1.0522119558339946,0.7488190702699817,1.3053620187518864
+6,SM31,0.9780000000000001,0.5840000000000002,1.392,1.1716569463797841,0.7308419801844992,1.5387657391558989
+12,SM37,1.0219999999999998,0.5029999999999999,1.65,1.3859870129261673,0.5973859723830147,2.002058940191322
+5,SM30,1.0699999999999998,0.607,1.666,1.3828810505607487,0.7125517525064408,2.0317357111593033
+0,SM25,1.07,0.7230000000000001,1.445,1.2163305471786854,0.868262633078264,1.5458783910773837
+7,SM32,1.097,0.651,1.576,1.3332104110004541,0.7998562370826398,1.7654234619490021
+14,SM39,1.116,0.715,1.526,1.296240718385285,0.8958794561770015,1.617485703182566
+10,SM35,1.16,0.6759999999999999,1.848,1.5276779765382493,0.7775152731618846,2.318644000272573
+19,SM44,1.307,0.8170000000000002,2.0,1.6417216572854245,0.9065042746727674,2.43043823208902
+9,SM34,1.434,0.8420000000000002,2.066,1.7410916116046278,1.072846680565308,2.2818632737304836
+20,SM45,1.545,1.113,2.092,1.7332830120900626,1.13149900574415,2.3097640572145024
+13,SM38,1.5550000000000002,0.9269999999999999,2.2489999999999997,1.8788214390941997,1.1432891147911801,2.5506842219294805
+11,SM36,1.614,0.932,2.277,1.9535762078813308,1.3125623794700196,2.4480053104517565
+8,SM33,1.6260000000000001,1.2820000000000003,1.989,1.720941602727995,1.3553412854333036,2.0620766232126293
+21,SM46,1.6949999999999998,1.242,2.201,1.864534794526506,1.3372209989377222,2.372614591542419
+16,SM41,2.021,1.7929999999999997,2.2640000000000002,2.056110405595964,1.814893936294901,2.300256507435638
+17,SM42,2.4,1.8259999999999998,3.0180000000000002,2.5871915275062265,1.9277940761398764,3.2033701003786623
+18,SM43,2.906,2.4880000000000004,3.3600000000000003,2.9908293164271345,2.5409171572485394,3.4326039678354974
diff --git a/...outputs_all_submissions/MolecularStatisticsTables/Physical_QM/MAE_vs_molecule_ID_plot.pdf b/...outputs_all_submissions/MolecularStatisticsTables/Physical_QM/MAE_vs_molecule_ID_plot.pdf
diff --git a/...utputs_all_submissions/MolecularStatisticsTables/Physical_QM/RMSE_vs_molecule_ID_plot.pdf b/...utputs_all_submissions/MolecularStatisticsTables/Physical_QM/RMSE_vs_molecule_ID_plot.pdf
diff --git a/...ecularStatisticsTables/Physical_QM/molecular_error_statistics_for_Physical_QM_methods.csv b/...ecularStatisticsTables/Physical_QM/molecular_error_statistics_for_Physical_QM_methods.csv
@@ -1,23 +1,23 @@
 ,Molecule ID,MAE,MAE_lower_CI,MAE_upper_CI,RMSE,RMSE_lower_CI,RMSE_upper_CI
-10,SM35,0.618,0.261,1.029,0.8762533880105686,0.35411862419251544,1.2215686636452328
-3,SM28,0.852,0.449,1.2900000000000003,1.0893208893618078,0.6309754353380169,1.4582832372347971
-2,SM27,0.8919999999999998,0.5129999999999999,1.296,1.095116432166005,0.6713344918891029,1.4477396174727002
-1,SM26,0.937,0.5890000000000001,1.2600000000000002,1.0807081012003195,0.8004935977258032,1.3051551631894196
-16,SM41,0.9719999999999999,0.42400000000000004,1.5510000000000002,1.3299398482638227,0.7435657334762005,1.8227451824103114
-7,SM32,1.0209999999999997,0.442,1.7840000000000003,1.5046095839120526,0.6334350795464364,2.3233790048117418
-4,SM29,1.139,0.653,1.6470000000000002,1.388254299471102,0.8215473206091053,1.8081012139811201
-5,SM30,1.267,0.6339999999999999,2.0929999999999995,1.744204689822843,0.7897974423863373,2.656891040295029
-18,SM43,1.2879999999999998,0.704,1.9689999999999999,1.6453996475020891,0.8505468828935886,2.288112759459201
-6,SM31,1.344,0.9199999999999999,1.8119999999999998,1.5277303426979514,1.0390957607458517,1.9943695745773902
-12,SM37,1.3780000000000001,0.8160000000000001,1.9720000000000002,1.6735351803891068,1.0223111072467128,2.1873819968171997
-11,SM36,1.4600000000000002,1.0180000000000002,1.936,1.6407193544296357,1.1328768688608661,2.098075308467263
-19,SM44,1.489,0.8380000000000001,2.205,1.8625708040232993,1.0970004557884194,2.4883066531277853
-14,SM39,1.5320000000000003,0.8809999999999999,2.163,1.8407172515082268,1.1957299026117898,2.321695501137046
-20,SM45,1.536,0.8659999999999999,2.266,1.9056494955788696,1.1352224451621804,2.523751176324639
-8,SM33,1.543,0.71,2.6929999999999996,2.2665414181082157,0.8882454615701675,3.545237650708341
-9,SM34,1.562,0.8540000000000003,2.4709999999999996,2.051774841448252,1.0354177900731667,3.038521021813079
-17,SM42,1.636,0.914,2.4970000000000003,2.082781793659624,1.1730728877610292,2.901179070653861
-13,SM38,1.6789999999999998,0.9629999999999999,2.502,2.10066418068191,1.1700641008081567,2.841423938802515
-21,SM46,1.687,1.052,2.412,2.015864578784994,1.1417836922990272,2.6773008796173805
-0,SM25,1.761,1.239,2.4259999999999997,2.0086836485619135,1.32459427750538,2.7244687555558422
-15,SM40,2.021,1.3070000000000002,2.778,2.337740361973502,1.4886336016629478,3.022141624742295
+10,SM35,0.584,0.217,0.9979999999999999,0.8601976517056996,0.23501063805708883,1.2017903311310172
+2,SM27,0.8089999999999999,0.4069999999999999,1.232,1.0522119558339946,0.5717866735068245,1.4186014239383802
+1,SM26,0.8550000000000001,0.49300000000000005,1.215,1.034973429610635,0.7167356555941667,1.2824039925078212
+3,SM28,0.876,0.48299999999999993,1.296,1.0983168941612433,0.6456392181396665,1.448913385955144
+16,SM41,0.89,0.382,1.47,1.247212892813412,0.6332613994236502,1.7623790738657787
+7,SM32,0.946,0.341,1.7429999999999999,1.4837789592793127,0.5628410077455267,2.315584159558879
+4,SM29,1.114,0.6300000000000001,1.6420000000000001,1.3807606599262598,0.821790727618656,1.8081012139811201
+18,SM43,1.205,0.675,1.8299999999999996,1.5328437624232938,0.8360980803709573,2.172291416914406
+5,SM30,1.2089999999999999,0.5659999999999997,2.085,1.730517263710478,0.7578720208584031,2.663124105256832
+6,SM31,1.2619999999999998,0.818,1.778,1.478079835462212,0.9351417004924975,1.9799191902701483
+12,SM37,1.296,0.702,1.9310000000000005,1.6398780442459737,0.9389355675444403,2.173948021457735
+11,SM36,1.377,0.9869999999999999,1.8290000000000002,1.5391848491977824,1.0789439281074804,2.0113850949035097
+14,SM39,1.457,0.785,2.133,1.823729694883537,1.1635033304636475,2.3132617664241977
+8,SM33,1.46,0.672,2.618,2.2035970593554532,0.8022032161491252,3.5050791717163823
+9,SM34,1.48,0.772,2.4159999999999995,2.001604356510047,0.9200217388735987,3.0172288610577755
+20,SM45,1.532,0.8459999999999998,2.2479999999999998,1.9047887021924503,1.101290152502963,2.519091105934837
+19,SM44,1.547,0.9189999999999999,2.237,1.875294643516053,1.0429908916189057,2.4946001683636596
+17,SM42,1.554,0.8400000000000001,2.3899999999999997,1.9971629878405017,1.0565367953838618,2.8403960991382875
+21,SM46,1.655,0.993,2.4159999999999995,2.009345664638118,1.115437134042076,2.6867768794598486
+13,SM38,1.6630000000000003,0.9180000000000001,2.5090000000000003,2.0975390342017475,1.067525175347167,2.8430775578587366
+0,SM25,1.6779999999999997,1.096,2.379,1.9751405013314876,1.2326110497638743,2.705712475485893
+15,SM40,1.939,1.1749999999999998,2.75,2.3215490518186344,1.4901879076143383,3.012635059213114
diff --git a/...s/analysis_outputs_all_submissions/MolecularStatisticsTables/RMSE_vs_molecule_ID_plot.pdf b/...s/analysis_outputs_all_submissions/MolecularStatisticsTables/RMSE_vs_molecule_ID_plot.pdf
diff --git a/...missions/MolecularStatisticsTables/molecular_MAE_comparison_between_method_categories.pdf b/...missions/MolecularStatisticsTables/molecular_MAE_comparison_between_method_categories.pdf
diff --git a/...issions/MolecularStatisticsTables/molecular_error_distribution_ridge_plot_all_methods.pdf b/...issions/MolecularStatisticsTables/molecular_error_distribution_ridge_plot_all_methods.pdf
diff --git a/...cularStatisticsTables/molecular_error_distribution_ridge_plot_well_performing_methods.pdf b/...cularStatisticsTables/molecular_error_distribution_ridge_plot_well_performing_methods.pdf
diff --git a/...analysis_outputs_all_submissions/MolecularStatisticsTables/molecular_error_statistics.csv b/...analysis_outputs_all_submissions/MolecularStatisticsTables/molecular_error_statistics.csv
@@ -1,23 +1,23 @@
 ,Molecule ID,MAE,MAE_lower_CI,MAE_upper_CI,RMSE,RMSE_lower_CI,RMSE_upper_CI
-1,SM26,0.8016216216216216,0.5732432432432433,1.0483783783783782,1.088442974210458,0.8283816851042859,1.3471280763364908
-3,SM28,0.8745945945945948,0.6124324324324324,1.1554054054054057,1.2096146359760893,0.8556647486966856,1.5494890177785112
-2,SM27,0.9013513513513514,0.614054054054054,1.2299999999999998,1.317133455858039,0.9031805661854861,1.7035947684631858
-10,SM35,0.9210810810810809,0.6754054054054055,1.2089189189189187,1.2384471532331733,0.8772638667424367,1.6077447693098688
-4,SM29,0.9508108108108108,0.6705405405405405,1.262972972972973,1.3199426686976403,0.9545679651025379,1.6524600825207016
-7,SM32,1.1489189189189188,0.771081081081081,1.5559459459459457,1.6742767700421286,1.153670991555546,2.12662783437675
-19,SM44,1.1521621621621618,0.8629729729729729,1.4764864864864864,1.4932053315475946,1.096970028416111,1.8652548554220882
-6,SM31,1.158918918918919,0.8316216216216217,1.5259459459459461,1.5762391093135997,1.1157557128739295,2.0171581561759173
-12,SM37,1.1913513513513514,0.8562162162162162,1.5651351351351348,1.6168855614788942,1.1891991400075073,2.0350244038645635
-14,SM39,1.218108108108108,0.8508108108108108,1.6291891891891894,1.710124857145532,1.2515385126509884,2.1244903999452336
-5,SM30,1.2402702702702701,0.7775675675675676,1.7537837837837835,1.981965309102681,1.2617930185341895,2.5721717608992534
-13,SM38,1.262702702702703,0.9199999999999999,1.6313513513513511,1.684724694808412,1.2758696027585434,2.06802490967276
-0,SM25,1.366756756756757,0.9294594594594595,1.8637837837837836,1.9778756007120093,1.3477939934013092,2.5434696455507066
-20,SM45,1.4075675675675676,1.0,1.863243243243244,1.9471017963643824,1.4157368437710485,2.4377010658582576
-16,SM41,1.4127027027027028,1.1689189189189189,1.6597297297297298,1.6039419346502946,1.3789410351347073,1.8190760945704934
-15,SM40,1.44,1.0978378378378377,1.820810810810811,1.8153028189049683,1.360490769955877,2.2438341943851134
-21,SM46,1.4543243243243245,1.1372972972972972,1.788918918918919,1.7611490413778006,1.3808448256167065,2.0992830178871045
-9,SM34,1.5056756756756755,1.0437837837837838,2.0121621621621624,2.1329214833307986,1.49542907157381,2.6904817211592222
-8,SM33,1.62,1.1127027027027032,2.1913513513513516,2.327287018153297,1.556974717286787,2.9989115142448384
-11,SM36,1.625135135135135,1.3464864864864865,1.9097297297297295,1.8448328130505778,1.5733807635238926,2.104040514459378
-18,SM43,1.793243243243243,1.451081081081081,2.1459459459459453,2.094465680426988,1.7379577950276288,2.4268782082827802
-17,SM42,1.9662162162162162,1.5727027027027027,2.3883783783783783,2.330310848073417,1.8776127741708966,2.7656889078736127
+1,SM26,0.793888888888889,0.5605555555555557,1.0458333333333336,1.0903490776403268,0.8195730595865142,1.3471461605103499
+3,SM28,0.8755555555555555,0.612777777777778,1.1652777777777779,1.2152686031399715,0.8478944509784222,1.5590346015688326
+2,SM27,0.8830555555555555,0.5805555555555556,1.228611111111111,1.3200894329972919,0.8882958090886417,1.7162135324279695
+10,SM35,0.9008333333333335,0.6425,1.200277777777778,1.2332646377264964,0.8513534975424589,1.6178681102680226
+4,SM29,0.9466666666666667,0.6552777777777777,1.267777777777778,1.3284619343854422,0.9536202948064113,1.6654612307439378
+7,SM32,1.1294444444444443,0.7466666666666667,1.5613888888888887,1.6823099199216136,1.1601891608220138,2.148909284058103
+6,SM31,1.1386111111111112,0.798611111111111,1.5149999999999997,1.5748924125511277,1.101529240041619,2.0195654097959905
+12,SM37,1.1530555555555553,0.8055555555555556,1.5294444444444446,1.60340003326265,1.1618770732454158,2.0251351120906036
+19,SM44,1.1838888888888888,0.888611111111111,1.5074999999999998,1.5149715802248203,1.1089033621856625,1.887068567322814
+14,SM39,1.2288888888888887,0.8472222222222222,1.6383333333333332,1.728668402107369,1.2631200347640057,2.1477022605566165
+5,SM30,1.257222222222222,0.7769444444444445,1.8055555555555556,2.005996565855042,1.2784235083362112,2.616710721497506
+13,SM38,1.2580555555555557,0.9025000000000001,1.6533333333333333,1.6937212482184507,1.2621982587709604,2.0861261280714123
+0,SM25,1.3747222222222224,0.9272222222222221,1.8727777777777783,1.9954455085964582,1.3431989180063144,2.5629859972739264
+15,SM40,1.4033333333333333,1.0530555555555554,1.7855555555555556,1.8059238940528781,1.3319690937355364,2.2385126510450837
+16,SM41,1.4116666666666666,1.1533333333333333,1.6544444444444444,1.6043205553892417,1.370055757178436,1.8142881983485057
+20,SM45,1.4433333333333331,1.0130555555555558,1.9036111111111111,1.9736838089668207,1.4284402916001306,2.465014649494445
+21,SM46,1.4575000000000002,1.1361111111111113,1.7980555555555553,1.7752785383958454,1.399325234215088,2.1197438262414843
+9,SM34,1.4869444444444442,1.0105555555555554,2.009444444444445,2.1372548592372724,1.4792678369157268,2.715765187853242
+11,SM36,1.6233333333333333,1.3391666666666664,1.9108333333333332,1.8405750912871408,1.5613046538783593,2.1009138223375294
+8,SM33,1.6297222222222225,1.1172222222222221,2.2225,2.3416192166011016,1.5625157776981182,3.046578682172293
+18,SM43,1.8066666666666664,1.4636111111111112,2.1588888888888884,2.0983022237566784,1.7365395027019814,2.4341368536346146
+17,SM42,1.9563888888888887,1.5519444444444443,2.379166666666667,2.328445475705483,1.8611667487537666,2.7684166152433693
diff --git a/physical_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/COSMO-RS_QQ.pdf b/physical_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/COSMO-RS_QQ.pdf
diff --git a/physical_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/Chemprop_QQ.pdf b/physical_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/Chemprop_QQ.pdf
diff --git a/...l_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/ClassicalGSG_DB1_QQ.pdf b/...l_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/ClassicalGSG_DB1_QQ.pdf
diff --git a/...l_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/ClassicalGSG_DB2_QQ.pdf b/...l_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/ClassicalGSG_DB2_QQ.pdf
diff --git a/...l_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/ClassicalGSG_DB3_QQ.pdf b/...l_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/ClassicalGSG_DB3_QQ.pdf
diff --git a/...l_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/ClassicalGSG_DB4_QQ.pdf b/...l_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/ClassicalGSG_DB4_QQ.pdf
diff --git a/physical_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/EC_RISM_wet_QQ.pdf b/physical_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/EC_RISM_wet_QQ.pdf
diff --git a/...perty/logP/analysis/analysis_outputs_all_submissions/QQPlots/Ensemble_EPI_physprop_QQ.pdf b/...perty/logP/analysis/analysis_outputs_all_submissions/QQPlots/Ensemble_EPI_physprop_QQ.pdf
diff --git a/...al_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/Ensemble_Martel_QQ.pdf b/...al_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/Ensemble_Martel_QQ.pdf
diff --git a/physical_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/GROVER_QQ.pdf b/physical_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/GROVER_QQ.pdf
diff --git a/...rty/logP/analysis/analysis_outputs_all_submissions/QQPlots/MD-EE-MCC_GAFF-TIP4P-Ew_QQ.pdf b/...rty/logP/analysis/analysis_outputs_all_submissions/QQPlots/MD-EE-MCC_GAFF-TIP4P-Ew_QQ.pdf
diff --git a/...al_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/MD_CGenFF_TIP3P_QQ.pdf b/...al_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/MD_CGenFF_TIP3P_QQ.pdf
diff --git a/...ical_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/MD_GAFF_TIP3P_QQ.pdf b/...ical_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/MD_GAFF_TIP3P_QQ.pdf
diff --git a/.../logP/analysis/analysis_outputs_all_submissions/QQPlots/MD_LigParGen_OPLS-AA_TIP4P_QQ.pdf b/.../logP/analysis/analysis_outputs_all_submissions/QQPlots/MD_LigParGen_OPLS-AA_TIP4P_QQ.pdf
diff --git a/...l_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/MD_OPLS-AA_TIP4P_QQ.pdf b/...l_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/MD_OPLS-AA_TIP4P_QQ.pdf
diff --git a/...property/logP/analysis/analysis_outputs_all_submissions/QQPlots/NES-1_GAFF2_OPC3_B_QQ.pdf b/...property/logP/analysis/analysis_outputs_all_submissions/QQPlots/NES-1_GAFF2_OPC3_B_QQ.pdf
diff --git a/...property/logP/analysis/analysis_outputs_all_submissions/QQPlots/NES-1_GAFF2_OPC3_G_QQ.pdf b/...property/logP/analysis/analysis_outputs_all_submissions/QQPlots/NES-1_GAFF2_OPC3_G_QQ.pdf
diff --git a/...property/logP/analysis/analysis_outputs_all_submissions/QQPlots/NES-1_GAFF2_OPC3_J_QQ.pdf b/...property/logP/analysis/analysis_outputs_all_submissions/QQPlots/NES-1_GAFF2_OPC3_J_QQ.pdf
diff --git a/...operty/logP/analysis/analysis_outputs_all_submissions/QQPlots/NULL0_mean_clogP_FDA_QQ.pdf b/...operty/logP/analysis/analysis_outputs_all_submissions/QQPlots/NULL0_mean_clogP_FDA_QQ.pdf
diff --git a/physical_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/QQplot_dict.pickle b/physical_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/QQplot_dict.pickle
diff --git a/.../logP/analysis/analysis_outputs_all_submissions/QQPlots/QSPR_Mordred2D_TPOT_AutoML_QQ.pdf b/.../logP/analysis/analysis_outputs_all_submissions/QQPlots/QSPR_Mordred2D_TPOT_AutoML_QQ.pdf
diff --git a/...ical_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/REF1_ChemAxon_QQ.pdf b/...ical_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/REF1_ChemAxon_QQ.pdf
diff --git a/...al_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/TFE-NHLBI-NN-IN_QQ.pdf b/...al_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/TFE-NHLBI-NN-IN_QQ.pdf
diff --git a/..._property/logP/analysis/analysis_outputs_all_submissions/QQPlots/TFE-NHLBI-TZVP-QM_QQ.pdf b/..._property/logP/analysis/analysis_outputs_all_submissions/QQPlots/TFE-NHLBI-TZVP-QM_QQ.pdf
diff --git a/...roperty/logP/analysis/analysis_outputs_all_submissions/QQPlots/TFE-SM12-vacuum-opt_QQ.pdf b/...roperty/logP/analysis/analysis_outputs_all_submissions/QQPlots/TFE-SM12-vacuum-opt_QQ.pdf
diff --git a/...roperty/logP/analysis/analysis_outputs_all_submissions/QQPlots/TFE-SM8-solvent-opt_QQ.pdf b/...roperty/logP/analysis/analysis_outputs_all_submissions/QQPlots/TFE-SM8-solvent-opt_QQ.pdf
diff --git a/...property/logP/analysis/analysis_outputs_all_submissions/QQPlots/TFE-SM8-vacuum-opt_QQ.pdf b/...property/logP/analysis/analysis_outputs_all_submissions/QQPlots/TFE-SM8-vacuum-opt_QQ.pdf
diff --git a/...roperty/logP/analysis/analysis_outputs_all_submissions/QQPlots/TFE-SMD-solvent-opt_QQ.pdf b/...roperty/logP/analysis/analysis_outputs_all_submissions/QQPlots/TFE-SMD-solvent-opt_QQ.pdf
diff --git a/...property/logP/analysis/analysis_outputs_all_submissions/QQPlots/TFE-SMD-vacuum-opt_QQ.pdf b/...property/logP/analysis/analysis_outputs_all_submissions/QQPlots/TFE-SMD-vacuum-opt_QQ.pdf
diff --git a/...l_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/TFE_Attentive_FP_QQ.pdf b/...l_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/TFE_Attentive_FP_QQ.pdf
diff --git a/...cal_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/TFE_IEFPCM_MST_QQ.pdf b/...cal_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/TFE_IEFPCM_MST_QQ.pdf
diff --git a/.../logP/analysis/analysis_outputs_all_submissions/QQPlots/TFE_MD_neat_oct_GAFF_TIP4P_QQ.pdf b/.../logP/analysis/analysis_outputs_all_submissions/QQPlots/TFE_MD_neat_oct_GAFF_TIP4P_QQ.pdf
diff --git a/physical_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/TFE_MLR_QQ.pdf b/physical_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/TFE_MLR_QQ.pdf
diff --git a/physical_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/TFE_b3lypd3_QQ.pdf b/physical_property/logP/analysis/analysis_outputs_all_submissions/QQPlots/TFE_b3lypd3_QQ.pdf
diff --git a/...erty/logP/analysis/analysis_outputs_all_submissions/QQPlots/TFE_wet_oct_GAFF_TIP4P_QQ.pdf b/...erty/logP/analysis/analysis_outputs_all_submissions/QQPlots/TFE_wet_oct_GAFF_TIP4P_QQ.pdf
diff --git a/.../logP/analysis/analysis_outputs_all_submissions/QQPlots/ffsampled_deeplearning_cl1_QQ.pdf b/.../logP/analysis/analysis_outputs_all_submissions/QQPlots/ffsampled_deeplearning_cl1_QQ.pdf
diff --git a/.../logP/analysis/analysis_outputs_all_submissions/QQPlots/ffsampled_deeplearning_cl2_QQ.pdf b/.../logP/analysis/analysis_outputs_all_submissions/QQPlots/ffsampled_deeplearning_cl2_QQ.pdf
diff --git a/...ty/logP/analysis/analysis_outputs_all_submissions/StatisticsTables/MAE_vs_method_plot.pdf b/...ty/logP/analysis/analysis_outputs_all_submissions/StatisticsTables/MAE_vs_method_plot.pdf
diff --git a/...utputs_all_submissions/StatisticsTables/MAE_vs_method_plot_colored_by_method_category.pdf b/...utputs_all_submissions/StatisticsTables/MAE_vs_method_plot_colored_by_method_category.pdf
diff --git a/.../analysis_outputs_all_submissions/StatisticsTables/MAE_vs_method_plot_colored_by_type.pdf b/.../analysis_outputs_all_submissions/StatisticsTables/MAE_vs_method_plot_colored_by_type.pdf
diff --git a/...is_outputs_all_submissions/StatisticsTables/MAE_vs_method_plot_for_Empirical_category.pdf b/...is_outputs_all_submissions/StatisticsTables/MAE_vs_method_plot_for_Empirical_category.pdf
diff --git a/..._outputs_all_submissions/StatisticsTables/MAE_vs_method_plot_for_Physical_MM_category.pdf b/..._outputs_all_submissions/StatisticsTables/MAE_vs_method_plot_for_Physical_MM_category.pdf
diff --git a/..._outputs_all_submissions/StatisticsTables/MAE_vs_method_plot_for_Physical_QM_category.pdf b/..._outputs_all_submissions/StatisticsTables/MAE_vs_method_plot_for_Physical_QM_category.pdf
diff --git a/..._all_submissions/StatisticsTables/MAE_vs_method_plot_physical_methods_colored_by_type.pdf b/..._all_submissions/StatisticsTables/MAE_vs_method_plot_physical_methods_colored_by_type.pdf
diff --git a/...ions/StatisticsTables/MAE_vs_method_plot_physical_methoods_colored_by_method_category.pdf b/...ions/StatisticsTables/MAE_vs_method_plot_physical_methoods_colored_by_method_category.pdf
diff --git a/...icsTables/MethodCategoryComparison/error_distribution_of_method_categories_ridge_plot.pdf b/...icsTables/MethodCategoryComparison/error_distribution_of_method_categories_ridge_plot.pdf