complex_id stringlengths 6 8 | ligand_pdbqt_path stringlengths 34 38 | target_pdbqt_path stringlengths 34 38 | decoys_pdbqt_path stringlengths 34 38 ⌀ | decoy_scores_csv_path stringlengths 38 42 ⌀ |
|---|---|---|---|---|
8DBI-HSX | data/8D/8DBI-HSX/8DBI-HSX_ligand.pdbqt | data/8D/8DBI-HSX/8DBI-HSX_target.pdbqt | data/8D/8DBI-HSX/8DBI-HSX_decoys.pdbqt | data/8D/8DBI-HSX/8DBI-HSX_decoy_scores.csv |
8D59-SAM | data/8D/8D59-SAM/8D59-SAM_ligand.pdbqt | data/8D/8D59-SAM/8D59-SAM_target.pdbqt | data/8D/8D59-SAM/8D59-SAM_decoys.pdbqt | data/8D/8D59-SAM/8D59-SAM_decoy_scores.csv |
8DVB-TZI | data/8D/8DVB-TZI/8DVB-TZI_ligand.pdbqt | data/8D/8DVB-TZI/8DVB-TZI_target.pdbqt | data/8D/8DVB-TZI/8DVB-TZI_decoys.pdbqt | data/8D/8DVB-TZI/8DVB-TZI_decoy_scores.csv |
8DJT-ASC | data/8D/8DJT-ASC/8DJT-ASC_ligand.pdbqt | data/8D/8DJT-ASC/8DJT-ASC_target.pdbqt | data/8D/8DJT-ASC/8DJT-ASC_decoys.pdbqt | data/8D/8DJT-ASC/8DJT-ASC_decoy_scores.csv |
8DYQ-AZM | data/8D/8DYQ-AZM/8DYQ-AZM_ligand.pdbqt | data/8D/8DYQ-AZM/8DYQ-AZM_target.pdbqt | data/8D/8DYQ-AZM/8DYQ-AZM_decoys.pdbqt | data/8D/8DYQ-AZM/8DYQ-AZM_decoy_scores.csv |
8D1F-DU0 | data/8D/8D1F-DU0/8D1F-DU0_ligand.pdbqt | data/8D/8D1F-DU0/8D1F-DU0_target.pdbqt | data/8D/8D1F-DU0/8D1F-DU0_decoys.pdbqt | data/8D/8D1F-DU0/8D1F-DU0_decoy_scores.csv |
8DE1-NXL | data/8D/8DE1-NXL/8DE1-NXL_ligand.pdbqt | data/8D/8DE1-NXL/8DE1-NXL_target.pdbqt | data/8D/8DE1-NXL/8DE1-NXL_decoys.pdbqt | data/8D/8DE1-NXL/8DE1-NXL_decoy_scores.csv |
8DHF-FMN | data/8D/8DHF-FMN/8DHF-FMN_ligand.pdbqt | data/8D/8DHF-FMN/8DHF-FMN_target.pdbqt | data/8D/8DHF-FMN/8DHF-FMN_decoys.pdbqt | data/8D/8DHF-FMN/8DHF-FMN_decoy_scores.csv |
8DHH-TMK | data/8D/8DHH-TMK/8DHH-TMK_ligand.pdbqt | data/8D/8DHH-TMK/8DHH-TMK_target.pdbqt | data/8D/8DHH-TMK/8DHH-TMK_decoys.pdbqt | data/8D/8DHH-TMK/8DHH-TMK_decoy_scores.csv |
8DKN-CXS | data/8D/8DKN-CXS/8DKN-CXS_ligand.pdbqt | data/8D/8DKN-CXS/8DKN-CXS_target.pdbqt | data/8D/8DKN-CXS/8DKN-CXS_decoys.pdbqt | data/8D/8DKN-CXS/8DKN-CXS_decoy_scores.csv |
8DAK-GDP | data/8D/8DAK-GDP/8DAK-GDP_ligand.pdbqt | data/8D/8DAK-GDP/8DAK-GDP_target.pdbqt | data/8D/8DAK-GDP/8DAK-GDP_decoys.pdbqt | data/8D/8DAK-GDP/8DAK-GDP_decoy_scores.csv |
8D1H-DU0 | data/8D/8D1H-DU0/8D1H-DU0_ligand.pdbqt | data/8D/8D1H-DU0/8D1H-DU0_target.pdbqt | data/8D/8D1H-DU0/8D1H-DU0_decoys.pdbqt | data/8D/8D1H-DU0/8D1H-DU0_decoy_scores.csv |
8D89-1PG | data/8D/8D89-1PG/8D89-1PG_ligand.pdbqt | data/8D/8D89-1PG/8D89-1PG_target.pdbqt | data/8D/8D89-1PG/8D89-1PG_decoys.pdbqt | data/8D/8D89-1PG/8D89-1PG_decoy_scores.csv |
8D1K-MC3 | data/8D/8D1K-MC3/8D1K-MC3_ligand.pdbqt | data/8D/8D1K-MC3/8D1K-MC3_target.pdbqt | data/8D/8D1K-MC3/8D1K-MC3_decoys.pdbqt | data/8D/8D1K-MC3/8D1K-MC3_decoy_scores.csv |
8DNI-U4L | data/8D/8DNI-U4L/8DNI-U4L_ligand.pdbqt | data/8D/8DNI-U4L/8DNI-U4L_target.pdbqt | data/8D/8DNI-U4L/8DNI-U4L_decoys.pdbqt | data/8D/8DNI-U4L/8DNI-U4L_decoy_scores.csv |
8D1G-DU0 | data/8D/8D1G-DU0/8D1G-DU0_ligand.pdbqt | data/8D/8D1G-DU0/8D1G-DU0_target.pdbqt | data/8D/8D1G-DU0/8D1G-DU0_decoys.pdbqt | data/8D/8D1G-DU0/8D1G-DU0_decoy_scores.csv |
8DU3-OLC | data/8D/8DU3-OLC/8DU3-OLC_ligand.pdbqt | data/8D/8DU3-OLC/8DU3-OLC_target.pdbqt | data/8D/8DU3-OLC/8DU3-OLC_decoys.pdbqt | data/8D/8DU3-OLC/8DU3-OLC_decoy_scores.csv |
8D4K-K36 | data/8D/8D4K-K36/8D4K-K36_ligand.pdbqt | data/8D/8D4K-K36/8D4K-K36_target.pdbqt | data/8D/8D4K-K36/8D4K-K36_decoys.pdbqt | data/8D/8D4K-K36/8D4K-K36_decoy_scores.csv |
8DC8-R50 | data/8D/8DC8-R50/8DC8-R50_ligand.pdbqt | data/8D/8DC8-R50/8DC8-R50_target.pdbqt | data/8D/8DC8-R50/8DC8-R50_decoys.pdbqt | data/8D/8DC8-R50/8DC8-R50_decoy_scores.csv |
8DVO-QQ4 | data/8D/8DVO-QQ4/8DVO-QQ4_ligand.pdbqt | data/8D/8DVO-QQ4/8DVO-QQ4_target.pdbqt | data/8D/8DVO-QQ4/8DVO-QQ4_decoys.pdbqt | data/8D/8DVO-QQ4/8DVO-QQ4_decoy_scores.csv |
8DI4-S9I | data/8D/8DI4-S9I/8DI4-S9I_ligand.pdbqt | data/8D/8DI4-S9I/8DI4-S9I_target.pdbqt | data/8D/8DI4-S9I/8DI4-S9I_decoys.pdbqt | data/8D/8DI4-S9I/8DI4-S9I_decoy_scores.csv |
8D1E-DU0 | data/8D/8D1E-DU0/8D1E-DU0_ligand.pdbqt | data/8D/8D1E-DU0/8D1E-DU0_target.pdbqt | data/8D/8D1E-DU0/8D1E-DU0_decoys.pdbqt | data/8D/8D1E-DU0/8D1E-DU0_decoy_scores.csv |
8DQS-QQ4 | data/8D/8DQS-QQ4/8DQS-QQ4_ligand.pdbqt | data/8D/8DQS-QQ4/8DQS-QQ4_target.pdbqt | data/8D/8DQS-QQ4/8DQS-QQ4_decoys.pdbqt | data/8D/8DQS-QQ4/8DQS-QQ4_decoy_scores.csv |
8D1G-MC3 | data/8D/8D1G-MC3/8D1G-MC3_ligand.pdbqt | data/8D/8D1G-MC3/8D1G-MC3_target.pdbqt | data/8D/8D1G-MC3/8D1G-MC3_decoys.pdbqt | data/8D/8D1G-MC3/8D1G-MC3_decoy_scores.csv |
8D1N-DU0 | data/8D/8D1N-DU0/8D1N-DU0_ligand.pdbqt | data/8D/8D1N-DU0/8D1N-DU0_target.pdbqt | data/8D/8D1N-DU0/8D1N-DU0_decoys.pdbqt | data/8D/8D1N-DU0/8D1N-DU0_decoy_scores.csv |
8DBJ-ATP | data/8D/8DBJ-ATP/8DBJ-ATP_ligand.pdbqt | data/8D/8DBJ-ATP/8DBJ-ATP_target.pdbqt | data/8D/8DBJ-ATP/8DBJ-ATP_decoys.pdbqt | data/8D/8DBJ-ATP/8DBJ-ATP_decoy_scores.csv |
8DU1-NAD | data/8D/8DU1-NAD/8DU1-NAD_ligand.pdbqt | data/8D/8DU1-NAD/8DU1-NAD_target.pdbqt | data/8D/8DU1-NAD/8DU1-NAD_decoys.pdbqt | data/8D/8DU1-NAD/8DU1-NAD_decoy_scores.csv |
8DB5-GDP | data/8D/8DB5-GDP/8DB5-GDP_ligand.pdbqt | data/8D/8DB5-GDP/8DB5-GDP_target.pdbqt | data/8D/8DB5-GDP/8DB5-GDP_decoys.pdbqt | data/8D/8DB5-GDP/8DB5-GDP_decoy_scores.csv |
8D5I-PT1 | data/8D/8D5I-PT1/8D5I-PT1_ligand.pdbqt | data/8D/8D5I-PT1/8D5I-PT1_target.pdbqt | data/8D/8D5I-PT1/8D5I-PT1_decoys.pdbqt | data/8D/8D5I-PT1/8D5I-PT1_decoy_scores.csv |
8DKG-NAI | data/8D/8DKG-NAI/8DKG-NAI_ligand.pdbqt | data/8D/8DKG-NAI/8DKG-NAI_target.pdbqt | data/8D/8DKG-NAI/8DKG-NAI_decoys.pdbqt | data/8D/8DKG-NAI/8DKG-NAI_decoy_scores.csv |
8D1C-M4F | data/8D/8D1C-M4F/8D1C-M4F_ligand.pdbqt | data/8D/8D1C-M4F/8D1C-M4F_target.pdbqt | data/8D/8D1C-M4F/8D1C-M4F_decoys.pdbqt | data/8D/8D1C-M4F/8D1C-M4F_decoy_scores.csv |
8DJE-U6S | data/8D/8DJE-U6S/8DJE-U6S_ligand.pdbqt | data/8D/8DJE-U6S/8DJE-U6S_target.pdbqt | data/8D/8DJE-U6S/8DJE-U6S_decoys.pdbqt | data/8D/8DJE-U6S/8DJE-U6S_decoy_scores.csv |
8DZ0-7YY | data/8D/8DZ0-7YY/8DZ0-7YY_ligand.pdbqt | data/8D/8DZ0-7YY/8DZ0-7YY_target.pdbqt | data/8D/8DZ0-7YY/8DZ0-7YY_decoys.pdbqt | data/8D/8DZ0-7YY/8DZ0-7YY_decoy_scores.csv |
8DZ2-4WI | data/8D/8DZ2-4WI/8DZ2-4WI_ligand.pdbqt | data/8D/8DZ2-4WI/8DZ2-4WI_target.pdbqt | data/8D/8DZ2-4WI/8DZ2-4WI_decoys.pdbqt | data/8D/8DZ2-4WI/8DZ2-4WI_decoy_scores.csv |
8DD9-B1S | data/8D/8DD9-B1S/8DD9-B1S_ligand.pdbqt | data/8D/8DD9-B1S/8DD9-B1S_target.pdbqt | data/8D/8DD9-B1S/8DD9-B1S_decoys.pdbqt | data/8D/8DD9-B1S/8DD9-B1S_decoy_scores.csv |
8D6C-QGR | data/8D/8D6C-QGR/8D6C-QGR_ligand.pdbqt | data/8D/8D6C-QGR/8D6C-QGR_target.pdbqt | data/8D/8D6C-QGR/8D6C-QGR_decoys.pdbqt | data/8D/8D6C-QGR/8D6C-QGR_decoy_scores.csv |
8DNK-GDP | data/8D/8DNK-GDP/8DNK-GDP_ligand.pdbqt | data/8D/8DNK-GDP/8DNK-GDP_target.pdbqt | data/8D/8DNK-GDP/8DNK-GDP_decoys.pdbqt | data/8D/8DNK-GDP/8DNK-GDP_decoy_scores.csv |
8DYG-U5Q | data/8D/8DYG-U5Q/8DYG-U5Q_ligand.pdbqt | data/8D/8DYG-U5Q/8DYG-U5Q_target.pdbqt | data/8D/8DYG-U5Q/8DYG-U5Q_decoys.pdbqt | data/8D/8DYG-U5Q/8DYG-U5Q_decoy_scores.csv |
8D6L-RH6 | data/8D/8D6L-RH6/8D6L-RH6_ligand.pdbqt | data/8D/8D6L-RH6/8D6L-RH6_target.pdbqt | data/8D/8D6L-RH6/8D6L-RH6_decoys.pdbqt | data/8D/8D6L-RH6/8D6L-RH6_decoy_scores.csv |
8DN1-RH6 | data/8D/8DN1-RH6/8DN1-RH6_ligand.pdbqt | data/8D/8DN1-RH6/8DN1-RH6_target.pdbqt | data/8D/8DN1-RH6/8DN1-RH6_decoys.pdbqt | data/8D/8DN1-RH6/8DN1-RH6_decoy_scores.csv |
8DU3-CLR | data/8D/8DU3-CLR/8DU3-CLR_ligand.pdbqt | data/8D/8DU3-CLR/8DU3-CLR_target.pdbqt | data/8D/8DU3-CLR/8DU3-CLR_decoys.pdbqt | data/8D/8DU3-CLR/8DU3-CLR_decoy_scores.csv |
8DBK-AMP | data/8D/8DBK-AMP/8DBK-AMP_ligand.pdbqt | data/8D/8DBK-AMP/8DBK-AMP_target.pdbqt | data/8D/8DBK-AMP/8DBK-AMP_decoys.pdbqt | data/8D/8DBK-AMP/8DBK-AMP_decoy_scores.csv |
8DQS-T8I | data/8D/8DQS-T8I/8DQS-T8I_ligand.pdbqt | data/8D/8DQS-T8I/8DQS-T8I_target.pdbqt | data/8D/8DQS-T8I/8DQS-T8I_decoys.pdbqt | data/8D/8DQS-T8I/8DQS-T8I_decoy_scores.csv |
8DHG-T78 | data/8D/8DHG-T78/8DHG-T78_ligand.pdbqt | data/8D/8DHG-T78/8DHG-T78_target.pdbqt | data/8D/8DHG-T78/8DHG-T78_decoys.pdbqt | data/8D/8DHG-T78/8DHG-T78_decoy_scores.csv |
8DCU-BEN | data/8D/8DCU-BEN/8DCU-BEN_ligand.pdbqt | data/8D/8DCU-BEN/8DCU-BEN_target.pdbqt | data/8D/8DCU-BEN/8DCU-BEN_decoys.pdbqt | data/8D/8DCU-BEN/8DCU-BEN_decoy_scores.csv |
8DJU-SIV | data/8D/8DJU-SIV/8DJU-SIV_ligand.pdbqt | data/8D/8DJU-SIV/8DJU-SIV_target.pdbqt | data/8D/8DJU-SIV/8DJU-SIV_decoys.pdbqt | data/8D/8DJU-SIV/8DJU-SIV_decoy_scores.csv |
8DZT-G4P | data/8D/8DZT-G4P/8DZT-G4P_ligand.pdbqt | data/8D/8DZT-G4P/8DZT-G4P_target.pdbqt | data/8D/8DZT-G4P/8DZT-G4P_decoys.pdbqt | data/8D/8DZT-G4P/8DZT-G4P_decoy_scores.csv |
8DQQ-07L | data/8D/8DQQ-07L/8DQQ-07L_ligand.pdbqt | data/8D/8DQQ-07L/8DQQ-07L_target.pdbqt | data/8D/8DQQ-07L/8DQQ-07L_decoys.pdbqt | data/8D/8DQQ-07L/8DQQ-07L_decoy_scores.csv |
8DTW-QQ4 | data/8D/8DTW-QQ4/8DTW-QQ4_ligand.pdbqt | data/8D/8DTW-QQ4/8DTW-QQ4_target.pdbqt | data/8D/8DTW-QQ4/8DTW-QQ4_decoys.pdbqt | data/8D/8DTW-QQ4/8DTW-QQ4_decoy_scores.csv |
8DIQ-GDP | data/8D/8DIQ-GDP/8DIQ-GDP_ligand.pdbqt | data/8D/8DIQ-GDP/8DIQ-GDP_target.pdbqt | data/8D/8DIQ-GDP/8DIQ-GDP_decoys.pdbqt | data/8D/8DIQ-GDP/8DIQ-GDP_decoy_scores.csv |
8DSG-BTB | data/8D/8DSG-BTB/8DSG-BTB_ligand.pdbqt | data/8D/8DSG-BTB/8DSG-BTB_target.pdbqt | data/8D/8DSG-BTB/8DSG-BTB_decoys.pdbqt | data/8D/8DSG-BTB/8DSG-BTB_decoy_scores.csv |
8D9A-QHO | data/8D/8D9A-QHO/8D9A-QHO_ligand.pdbqt | data/8D/8D9A-QHO/8D9A-QHO_target.pdbqt | data/8D/8D9A-QHO/8D9A-QHO_decoys.pdbqt | data/8D/8D9A-QHO/8D9A-QHO_decoy_scores.csv |
8DCV-NDG | data/8D/8DCV-NDG/8DCV-NDG_ligand.pdbqt | data/8D/8DCV-NDG/8DCV-NDG_target.pdbqt | data/8D/8DCV-NDG/8DCV-NDG_decoys.pdbqt | data/8D/8DCV-NDG/8DCV-NDG_decoy_scores.csv |
8DT1-NAD | data/8D/8DT1-NAD/8DT1-NAD_ligand.pdbqt | data/8D/8DT1-NAD/8DT1-NAD_target.pdbqt | data/8D/8DT1-NAD/8DT1-NAD_decoys.pdbqt | data/8D/8DT1-NAD/8DT1-NAD_decoy_scores.csv |
8DPR-T43 | data/8D/8DPR-T43/8DPR-T43_ligand.pdbqt | data/8D/8DPR-T43/8DPR-T43_target.pdbqt | data/8D/8DPR-T43/8DPR-T43_decoys.pdbqt | data/8D/8DPR-T43/8DPR-T43_decoy_scores.csv |
8DHN-T6U | data/8D/8DHN-T6U/8DHN-T6U_ligand.pdbqt | data/8D/8DHN-T6U/8DHN-T6U_target.pdbqt | data/8D/8DHN-T6U/8DHN-T6U_decoys.pdbqt | data/8D/8DHN-T6U/8DHN-T6U_decoy_scores.csv |
8DB0-TRP | data/8D/8DB0-TRP/8DB0-TRP_ligand.pdbqt | data/8D/8DB0-TRP/8DB0-TRP_target.pdbqt | data/8D/8DB0-TRP/8DB0-TRP_decoys.pdbqt | data/8D/8DB0-TRP/8DB0-TRP_decoy_scores.csv |
8DQJ-T7Q | data/8D/8DQJ-T7Q/8DQJ-T7Q_ligand.pdbqt | data/8D/8DQJ-T7Q/8DQJ-T7Q_target.pdbqt | data/8D/8DQJ-T7Q/8DQJ-T7Q_decoys.pdbqt | data/8D/8DQJ-T7Q/8DQJ-T7Q_decoy_scores.csv |
8DPJ-QQ4 | data/8D/8DPJ-QQ4/8DPJ-QQ4_ligand.pdbqt | data/8D/8DPJ-QQ4/8DPJ-QQ4_target.pdbqt | data/8D/8DPJ-QQ4/8DPJ-QQ4_decoys.pdbqt | data/8D/8DPJ-QQ4/8DPJ-QQ4_decoy_scores.csv |
8DTC-BGC | data/8D/8DTC-BGC/8DTC-BGC_ligand.pdbqt | data/8D/8DTC-BGC/8DTC-BGC_target.pdbqt | data/8D/8DTC-BGC/8DTC-BGC_decoys.pdbqt | data/8D/8DTC-BGC/8DTC-BGC_decoy_scores.csv |
8D6H-RH6 | data/8D/8D6H-RH6/8D6H-RH6_ligand.pdbqt | data/8D/8D6H-RH6/8D6H-RH6_target.pdbqt | data/8D/8D6H-RH6/8D6H-RH6_decoys.pdbqt | data/8D/8D6H-RH6/8D6H-RH6_decoy_scores.csv |
8DQP-T83 | data/8D/8DQP-T83/8DQP-T83_ligand.pdbqt | data/8D/8DQP-T83/8DQP-T83_target.pdbqt | data/8D/8DQP-T83/8DQP-T83_decoys.pdbqt | data/8D/8DQP-T83/8DQP-T83_decoy_scores.csv |
8D5R-ORX | data/8D/8D5R-ORX/8D5R-ORX_ligand.pdbqt | data/8D/8D5R-ORX/8D5R-ORX_target.pdbqt | data/8D/8D5R-ORX/8D5R-ORX_decoys.pdbqt | data/8D/8D5R-ORX/8D5R-ORX_decoy_scores.csv |
8D13-ADP | data/8D/8D13-ADP/8D13-ADP_ligand.pdbqt | data/8D/8D13-ADP/8D13-ADP_target.pdbqt | data/8D/8D13-ADP/8D13-ADP_decoys.pdbqt | data/8D/8D13-ADP/8D13-ADP_decoy_scores.csv |
8DZX-HC4 | data/8D/8DZX-HC4/8DZX-HC4_ligand.pdbqt | data/8D/8DZX-HC4/8DZX-HC4_target.pdbqt | data/8D/8DZX-HC4/8DZX-HC4_decoys.pdbqt | data/8D/8DZX-HC4/8DZX-HC4_decoy_scores.csv |
8DE0-NXL | data/8D/8DE0-NXL/8DE0-NXL_ligand.pdbqt | data/8D/8DE0-NXL/8DE0-NXL_target.pdbqt | data/8D/8DE0-NXL/8DE0-NXL_decoys.pdbqt | data/8D/8DE0-NXL/8DE0-NXL_decoy_scores.csv |
8DD1-K36 | data/8D/8DD1-K36/8DD1-K36_ligand.pdbqt | data/8D/8DD1-K36/8DD1-K36_target.pdbqt | data/8D/8DD1-K36/8DD1-K36_decoys.pdbqt | data/8D/8DD1-K36/8DD1-K36_decoy_scores.csv |
8DQI-ATP | data/8D/8DQI-ATP/8DQI-ATP_ligand.pdbqt | data/8D/8DQI-ATP/8DQI-ATP_target.pdbqt | data/8D/8DQI-ATP/8DQI-ATP_decoys.pdbqt | data/8D/8DQI-ATP/8DQI-ATP_decoy_scores.csv |
8DB2-RH6 | data/8D/8DB2-RH6/8DB2-RH6_ligand.pdbqt | data/8D/8DB2-RH6/8DB2-RH6_target.pdbqt | data/8D/8DB2-RH6/8DB2-RH6_decoys.pdbqt | data/8D/8DB2-RH6/8DB2-RH6_decoy_scores.csv |
8DQG-T7Q | data/8D/8DQG-T7Q/8DQG-T7Q_ligand.pdbqt | data/8D/8DQG-T7Q/8DQG-T7Q_target.pdbqt | data/8D/8DQG-T7Q/8DQG-T7Q_decoys.pdbqt | data/8D/8DQG-T7Q/8DQG-T7Q_decoy_scores.csv |
8DJS-ASC | data/8D/8DJS-ASC/8DJS-ASC_ligand.pdbqt | data/8D/8DJS-ASC/8DJS-ASC_target.pdbqt | data/8D/8DJS-ASC/8DJS-ASC_decoys.pdbqt | data/8D/8DJS-ASC/8DJS-ASC_decoy_scores.csv |
8DBN-ATP | data/8D/8DBN-ATP/8DBN-ATP_ligand.pdbqt | data/8D/8DBN-ATP/8DBN-ATP_target.pdbqt | data/8D/8DBN-ATP/8DBN-ATP_decoys.pdbqt | data/8D/8DBN-ATP/8DBN-ATP_decoy_scores.csv |
8DSH-A12 | data/8D/8DSH-A12/8DSH-A12_ligand.pdbqt | data/8D/8DSH-A12/8DSH-A12_target.pdbqt | data/8D/8DSH-A12/8DSH-A12_decoys.pdbqt | data/8D/8DSH-A12/8DSH-A12_decoy_scores.csv |
8DU3-OLA | data/8D/8DU3-OLA/8DU3-OLA_ligand.pdbqt | data/8D/8DU3-OLA/8DU3-OLA_target.pdbqt | data/8D/8DU3-OLA/8DU3-OLA_decoys.pdbqt | data/8D/8DU3-OLA/8DU3-OLA_decoy_scores.csv |
8DCZ-4WI | data/8D/8DCZ-4WI/8DCZ-4WI_ligand.pdbqt | data/8D/8DCZ-4WI/8DCZ-4WI_target.pdbqt | data/8D/8DCZ-4WI/8DCZ-4WI_decoys.pdbqt | data/8D/8DCZ-4WI/8DCZ-4WI_decoy_scores.csv |
8DBF-ADP | data/8D/8DBF-ADP/8DBF-ADP_ligand.pdbqt | data/8D/8DBF-ADP/8DBF-ADP_target.pdbqt | data/8D/8DBF-ADP/8DBF-ADP_decoys.pdbqt | data/8D/8DBF-ADP/8DBF-ADP_decoy_scores.csv |
8DJD-U3E | data/8D/8DJD-U3E/8DJD-U3E_ligand.pdbqt | data/8D/8DJD-U3E/8DJD-U3E_target.pdbqt | data/8D/8DJD-U3E/8DJD-U3E_decoys.pdbqt | data/8D/8DJD-U3E/8DJD-U3E_decoy_scores.csv |
8DKN-EEY | data/8D/8DKN-EEY/8DKN-EEY_ligand.pdbqt | data/8D/8DKN-EEY/8DKN-EEY_target.pdbqt | data/8D/8DKN-EEY/8DKN-EEY_decoys.pdbqt | data/8D/8DKN-EEY/8DKN-EEY_decoy_scores.csv |
8DZ1-7YY | data/8D/8DZ1-7YY/8DZ1-7YY_ligand.pdbqt | data/8D/8DZ1-7YY/8DZ1-7YY_target.pdbqt | data/8D/8DZ1-7YY/8DZ1-7YY_decoys.pdbqt | data/8D/8DZ1-7YY/8DZ1-7YY_decoy_scores.csv |
8DB0-DST | data/8D/8DB0-DST/8DB0-DST_ligand.pdbqt | data/8D/8DB0-DST/8DB0-DST_target.pdbqt | data/8D/8DB0-DST/8DB0-DST_decoys.pdbqt | data/8D/8DB0-DST/8DB0-DST_decoy_scores.csv |
8DBG-ATP | data/8D/8DBG-ATP/8DBG-ATP_ligand.pdbqt | data/8D/8DBG-ATP/8DBG-ATP_target.pdbqt | data/8D/8DBG-ATP/8DBG-ATP_decoys.pdbqt | data/8D/8DBG-ATP/8DBG-ATP_decoy_scores.csv |
8DBI-ATP | data/8D/8DBI-ATP/8DBI-ATP_ligand.pdbqt | data/8D/8DBI-ATP/8DBI-ATP_target.pdbqt | data/8D/8DBI-ATP/8DBI-ATP_decoys.pdbqt | data/8D/8DBI-ATP/8DBI-ATP_decoy_scores.csv |
8DNJ-U4U | data/8D/8DNJ-U4U/8DNJ-U4U_ligand.pdbqt | data/8D/8DNJ-U4U/8DNJ-U4U_target.pdbqt | data/8D/8DNJ-U4U/8DNJ-U4U_decoys.pdbqt | data/8D/8DNJ-U4U/8DNJ-U4U_decoy_scores.csv |
8DDE-R7C | data/8D/8DDE-R7C/8DDE-R7C_ligand.pdbqt | data/8D/8DDE-R7C/8DDE-R7C_target.pdbqt | data/8D/8DDE-R7C/8DDE-R7C_decoys.pdbqt | data/8D/8DDE-R7C/8DDE-R7C_decoy_scores.csv |
8DHH-FMN | data/8D/8DHH-FMN/8DHH-FMN_ligand.pdbqt | data/8D/8DHH-FMN/8DHH-FMN_target.pdbqt | data/8D/8DHH-FMN/8DHH-FMN_decoys.pdbqt | data/8D/8DHH-FMN/8DHH-FMN_decoy_scores.csv |
8DIQ-ACP | data/8D/8DIQ-ACP/8DIQ-ACP_ligand.pdbqt | data/8D/8DIQ-ACP/8DIQ-ACP_target.pdbqt | data/8D/8DIQ-ACP/8DIQ-ACP_decoys.pdbqt | data/8D/8DIQ-ACP/8DIQ-ACP_decoy_scores.csv |
8DKT-GTP | data/8D/8DKT-GTP/8DKT-GTP_ligand.pdbqt | data/8D/8DKT-GTP/8DKT-GTP_target.pdbqt | data/8D/8DKT-GTP/8DKT-GTP_decoys.pdbqt | data/8D/8DKT-GTP/8DKT-GTP_decoy_scores.csv |
8DV7-TXK | data/8D/8DV7-TXK/8DV7-TXK_ligand.pdbqt | data/8D/8DV7-TXK/8DV7-TXK_target.pdbqt | data/8D/8DV7-TXK/8DV7-TXK_decoys.pdbqt | data/8D/8DV7-TXK/8DV7-TXK_decoy_scores.csv |
8DQJ-AMP | data/8D/8DQJ-AMP/8DQJ-AMP_ligand.pdbqt | data/8D/8DQJ-AMP/8DQJ-AMP_target.pdbqt | data/8D/8DQJ-AMP/8DQJ-AMP_decoys.pdbqt | data/8D/8DQJ-AMP/8DQJ-AMP_decoy_scores.csv |
8DSH-QCT | data/8D/8DSH-QCT/8DSH-QCT_ligand.pdbqt | data/8D/8DSH-QCT/8DSH-QCT_target.pdbqt | data/8D/8DSH-QCT/8DSH-QCT_decoys.pdbqt | data/8D/8DSH-QCT/8DSH-QCT_decoy_scores.csv |
8DQH-ATP | data/8D/8DQH-ATP/8DQH-ATP_ligand.pdbqt | data/8D/8DQH-ATP/8DQH-ATP_target.pdbqt | data/8D/8DQH-ATP/8DQH-ATP_decoys.pdbqt | data/8D/8DQH-ATP/8DQH-ATP_decoy_scores.csv |
8DCH-G52 | data/8D/8DCH-G52/8DCH-G52_ligand.pdbqt | data/8D/8DCH-G52/8DCH-G52_target.pdbqt | data/8D/8DCH-G52/8DCH-G52_decoys.pdbqt | data/8D/8DCH-G52/8DCH-G52_decoy_scores.csv |
8DB0-PE8 | data/8D/8DB0-PE8/8DB0-PE8_ligand.pdbqt | data/8D/8DB0-PE8/8DB0-PE8_target.pdbqt | data/8D/8DB0-PE8/8DB0-PE8_decoys.pdbqt | data/8D/8DB0-PE8/8DB0-PE8_decoy_scores.csv |
8DIQ-JVI | data/8D/8DIQ-JVI/8DIQ-JVI_ligand.pdbqt | data/8D/8DIQ-JVI/8DIQ-JVI_target.pdbqt | data/8D/8DIQ-JVI/8DIQ-JVI_decoys.pdbqt | data/8D/8DIQ-JVI/8DIQ-JVI_decoy_scores.csv |
8DNI-GDP | data/8D/8DNI-GDP/8DNI-GDP_ligand.pdbqt | data/8D/8DNI-GDP/8DNI-GDP_target.pdbqt | data/8D/8DNI-GDP/8DNI-GDP_decoys.pdbqt | data/8D/8DNI-GDP/8DNI-GDP_decoy_scores.csv |
8D73-QCR | data/8D/8D73-QCR/8D73-QCR_ligand.pdbqt | data/8D/8D73-QCR/8D73-QCR_target.pdbqt | data/8D/8D73-QCR/8D73-QCR_decoys.pdbqt | data/8D/8D73-QCR/8D73-QCR_decoy_scores.csv |
8DOJ-T1I | data/8D/8DOJ-T1I/8DOJ-T1I_ligand.pdbqt | data/8D/8DOJ-T1I/8DOJ-T1I_target.pdbqt | data/8D/8DOJ-T1I/8DOJ-T1I_decoys.pdbqt | data/8D/8DOJ-T1I/8DOJ-T1I_decoy_scores.csv |
8D9C-QI5 | data/8D/8D9C-QI5/8D9C-QI5_ligand.pdbqt | data/8D/8D9C-QI5/8D9C-QI5_target.pdbqt | data/8D/8D9C-QI5/8D9C-QI5_decoys.pdbqt | data/8D/8D9C-QI5/8D9C-QI5_decoy_scores.csv |
8D9B-QI8 | data/8D/8D9B-QI8/8D9B-QI8_ligand.pdbqt | data/8D/8D9B-QI8/8D9B-QI8_target.pdbqt | data/8D/8D9B-QI8/8D9B-QI8_decoys.pdbqt | data/8D/8D9B-QI8/8D9B-QI8_decoy_scores.csv |
8DCV-BEN | data/8D/8DCV-BEN/8DCV-BEN_ligand.pdbqt | data/8D/8DCV-BEN/8DCV-BEN_target.pdbqt | data/8D/8DCV-BEN/8DCV-BEN_decoys.pdbqt | data/8D/8DCV-BEN/8DCV-BEN_decoy_scores.csv |
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