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 ⌀ |
|---|---|---|---|---|
1J1F-5GP | data/1J/1J1F-5GP/1J1F-5GP_ligand.pdbqt | data/1J/1J1F-5GP/1J1F-5GP_target.pdbqt | data/1J/1J1F-5GP/1J1F-5GP_decoys.pdbqt | data/1J/1J1F-5GP/1J1F-5GP_decoy_scores.csv |
1JDZ-FMB | data/1J/1JDZ-FMB/1JDZ-FMB_ligand.pdbqt | data/1J/1JDZ-FMB/1JDZ-FMB_target.pdbqt | data/1J/1JDZ-FMB/1JDZ-FMB_decoys.pdbqt | data/1J/1JDZ-FMB/1JDZ-FMB_decoy_scores.csv |
1JVG-UD2 | data/1J/1JVG-UD2/1JVG-UD2_ligand.pdbqt | data/1J/1JVG-UD2/1JVG-UD2_target.pdbqt | data/1J/1JVG-UD2/1JVG-UD2_decoys.pdbqt | data/1J/1JVG-UD2/1JVG-UD2_decoy_scores.csv |
1JWT-BLI | data/1J/1JWT-BLI/1JWT-BLI_ligand.pdbqt | data/1J/1JWT-BLI/1JWT-BLI_target.pdbqt | data/1J/1JWT-BLI/1JWT-BLI_decoys.pdbqt | data/1J/1JWT-BLI/1JWT-BLI_decoy_scores.csv |
1JTV-TES | data/1J/1JTV-TES/1JTV-TES_ligand.pdbqt | data/1J/1JTV-TES/1JTV-TES_target.pdbqt | data/1J/1JTV-TES/1JTV-TES_decoys.pdbqt | data/1J/1JTV-TES/1JTV-TES_decoy_scores.csv |
1J1B-ANP | data/1J/1J1B-ANP/1J1B-ANP_ligand.pdbqt | data/1J/1J1B-ANP/1J1B-ANP_target.pdbqt | data/1J/1J1B-ANP/1J1B-ANP_decoys.pdbqt | data/1J/1J1B-ANP/1J1B-ANP_decoy_scores.csv |
1JXM-5GP | data/1J/1JXM-5GP/1JXM-5GP_ligand.pdbqt | data/1J/1JXM-5GP/1JXM-5GP_target.pdbqt | data/1J/1JXM-5GP/1JXM-5GP_decoys.pdbqt | data/1J/1JXM-5GP/1JXM-5GP_decoy_scores.csv |
1JDB-GLN | data/1J/1JDB-GLN/1JDB-GLN_ligand.pdbqt | data/1J/1JDB-GLN/1JDB-GLN_target.pdbqt | data/1J/1JDB-GLN/1JDB-GLN_decoys.pdbqt | data/1J/1JDB-GLN/1JDB-GLN_decoy_scores.csv |
1JHQ-PMO | data/1J/1JHQ-PMO/1JHQ-PMO_ligand.pdbqt | data/1J/1JHQ-PMO/1JHQ-PMO_target.pdbqt | data/1J/1JHQ-PMO/1JHQ-PMO_decoys.pdbqt | data/1J/1JHQ-PMO/1JHQ-PMO_decoy_scores.csv |
1J4H-SUB | data/1J/1J4H-SUB/1J4H-SUB_ligand.pdbqt | data/1J/1J4H-SUB/1J4H-SUB_target.pdbqt | data/1J/1J4H-SUB/1J4H-SUB_decoys.pdbqt | data/1J/1J4H-SUB/1J4H-SUB_decoy_scores.csv |
1J1C-ADP | data/1J/1J1C-ADP/1J1C-ADP_ligand.pdbqt | data/1J/1J1C-ADP/1J1C-ADP_target.pdbqt | data/1J/1J1C-ADP/1J1C-ADP_decoys.pdbqt | data/1J/1J1C-ADP/1J1C-ADP_decoy_scores.csv |
1J15-BEN | data/1J/1J15-BEN/1J15-BEN_ligand.pdbqt | data/1J/1J15-BEN/1J15-BEN_target.pdbqt | data/1J/1J15-BEN/1J15-BEN_decoys.pdbqt | data/1J/1J15-BEN/1J15-BEN_decoy_scores.csv |
1JX2-ADP | data/1J/1JX2-ADP/1JX2-ADP_ligand.pdbqt | data/1J/1JX2-ADP/1JX2-ADP_target.pdbqt | data/1J/1JX2-ADP/1JX2-ADP_decoys.pdbqt | data/1J/1JX2-ADP/1JX2-ADP_decoy_scores.csv |
1JPJ-GNP | data/1J/1JPJ-GNP/1JPJ-GNP_ligand.pdbqt | data/1J/1JPJ-GNP/1JPJ-GNP_target.pdbqt | data/1J/1JPJ-GNP/1JPJ-GNP_decoys.pdbqt | data/1J/1JPJ-GNP/1JPJ-GNP_decoy_scores.csv |
1JRC-FMN | data/1J/1JRC-FMN/1JRC-FMN_ligand.pdbqt | data/1J/1JRC-FMN/1JRC-FMN_target.pdbqt | data/1J/1JRC-FMN/1JRC-FMN_decoys.pdbqt | data/1J/1JRC-FMN/1JRC-FMN_decoy_scores.csv |
1JB0-PQN | data/1J/1JB0-PQN/1JB0-PQN_ligand.pdbqt | data/1J/1JB0-PQN/1JB0-PQN_target.pdbqt | data/1J/1JB0-PQN/1JB0-PQN_decoys.pdbqt | data/1J/1JB0-PQN/1JB0-PQN_decoy_scores.csv |
1JGJ-RET | data/1J/1JGJ-RET/1JGJ-RET_ligand.pdbqt | data/1J/1JGJ-RET/1JGJ-RET_target.pdbqt | data/1J/1JGJ-RET/1JGJ-RET_decoys.pdbqt | data/1J/1JGJ-RET/1JGJ-RET_decoy_scores.csv |
1JCR-FPP | data/1J/1JCR-FPP/1JCR-FPP_ligand.pdbqt | data/1J/1JCR-FPP/1JCR-FPP_target.pdbqt | data/1J/1JCR-FPP/1JCR-FPP_decoys.pdbqt | data/1J/1JCR-FPP/1JCR-FPP_decoy_scores.csv |
1JKH-EFZ | data/1J/1JKH-EFZ/1JKH-EFZ_ligand.pdbqt | data/1J/1JKH-EFZ/1JKH-EFZ_target.pdbqt | data/1J/1JKH-EFZ/1JKH-EFZ_decoys.pdbqt | data/1J/1JKH-EFZ/1JKH-EFZ_decoy_scores.csv |
1JBU-BEN | data/1J/1JBU-BEN/1JBU-BEN_ligand.pdbqt | data/1J/1JBU-BEN/1JBU-BEN_target.pdbqt | data/1J/1JBU-BEN/1JBU-BEN_decoys.pdbqt | data/1J/1JBU-BEN/1JBU-BEN_decoy_scores.csv |
1JIO-DEB | data/1J/1JIO-DEB/1JIO-DEB_ligand.pdbqt | data/1J/1JIO-DEB/1JIO-DEB_target.pdbqt | data/1J/1JIO-DEB/1JIO-DEB_decoys.pdbqt | data/1J/1JIO-DEB/1JIO-DEB_decoy_scores.csv |
1J96-TES | data/1J/1J96-TES/1J96-TES_ligand.pdbqt | data/1J/1J96-TES/1J96-TES_target.pdbqt | data/1J/1J96-TES/1J96-TES_decoys.pdbqt | data/1J/1J96-TES/1J96-TES_decoy_scores.csv |
1JT1-MCO | data/1J/1JT1-MCO/1JT1-MCO_ligand.pdbqt | data/1J/1JT1-MCO/1JT1-MCO_target.pdbqt | data/1J/1JT1-MCO/1JT1-MCO_decoys.pdbqt | data/1J/1JT1-MCO/1JT1-MCO_decoy_scores.csv |
1JJ9-BBT | data/1J/1JJ9-BBT/1JJ9-BBT_ligand.pdbqt | data/1J/1JJ9-BBT/1JJ9-BBT_target.pdbqt | data/1J/1JJ9-BBT/1JJ9-BBT_decoys.pdbqt | data/1J/1JJ9-BBT/1JJ9-BBT_decoy_scores.csv |
1JCJ-HPD | data/1J/1JCJ-HPD/1JCJ-HPD_ligand.pdbqt | data/1J/1JCJ-HPD/1JCJ-HPD_target.pdbqt | data/1J/1JCJ-HPD/1JCJ-HPD_decoys.pdbqt | data/1J/1JCJ-HPD/1JCJ-HPD_decoy_scores.csv |
1JF7-TBH | data/1J/1JF7-TBH/1JF7-TBH_ligand.pdbqt | data/1J/1JF7-TBH/1JF7-TBH_target.pdbqt | data/1J/1JF7-TBH/1JF7-TBH_decoys.pdbqt | data/1J/1JF7-TBH/1JF7-TBH_decoy_scores.csv |
1J2C-BLA | data/1J/1J2C-BLA/1J2C-BLA_ligand.pdbqt | data/1J/1J2C-BLA/1J2C-BLA_target.pdbqt | data/1J/1J2C-BLA/1J2C-BLA_decoys.pdbqt | data/1J/1J2C-BLA/1J2C-BLA_decoy_scores.csv |
1JMH-UMP | data/1J/1JMH-UMP/1JMH-UMP_ligand.pdbqt | data/1J/1JMH-UMP/1JMH-UMP_target.pdbqt | data/1J/1JMH-UMP/1JMH-UMP_decoys.pdbqt | data/1J/1JMH-UMP/1JMH-UMP_decoy_scores.csv |
1JZ5-149 | data/1J/1JZ5-149/1JZ5-149_ligand.pdbqt | data/1J/1JZ5-149/1JZ5-149_target.pdbqt | data/1J/1JZ5-149/1JZ5-149_decoys.pdbqt | data/1J/1JZ5-149/1JZ5-149_decoy_scores.csv |
1JV7-LI1 | data/1J/1JV7-LI1/1JV7-LI1_ligand.pdbqt | data/1J/1JV7-LI1/1JV7-LI1_target.pdbqt | data/1J/1JV7-LI1/1JV7-LI1_decoys.pdbqt | data/1J/1JV7-LI1/1JV7-LI1_decoy_scores.csv |
1JUB-FMN | data/1J/1JUB-FMN/1JUB-FMN_ligand.pdbqt | data/1J/1JUB-FMN/1JUB-FMN_target.pdbqt | data/1J/1JUB-FMN/1JUB-FMN_decoys.pdbqt | data/1J/1JUB-FMN/1JUB-FMN_decoy_scores.csv |
1J4N-BNG | data/1J/1J4N-BNG/1J4N-BNG_ligand.pdbqt | data/1J/1J4N-BNG/1J4N-BNG_target.pdbqt | data/1J/1J4N-BNG/1J4N-BNG_decoys.pdbqt | data/1J/1J4N-BNG/1J4N-BNG_decoy_scores.csv |
1JDT-MTA | data/1J/1JDT-MTA/1JDT-MTA_ligand.pdbqt | data/1J/1JDT-MTA/1JDT-MTA_target.pdbqt | data/1J/1JDT-MTA/1JDT-MTA_decoys.pdbqt | data/1J/1JDT-MTA/1JDT-MTA_decoy_scores.csv |
1JJV-ATP | data/1J/1JJV-ATP/1JJV-ATP_ligand.pdbqt | data/1J/1JJV-ATP/1JJV-ATP_target.pdbqt | data/1J/1JJV-ATP/1JJV-ATP_decoys.pdbqt | data/1J/1JJV-ATP/1JJV-ATP_decoy_scores.csv |
1J54-TMP | data/1J/1J54-TMP/1J54-TMP_ligand.pdbqt | data/1J/1J54-TMP/1J54-TMP_target.pdbqt | data/1J/1J54-TMP/1J54-TMP_decoys.pdbqt | data/1J/1J54-TMP/1J54-TMP_decoy_scores.csv |
1JV1-UD1 | data/1J/1JV1-UD1/1JV1-UD1_ligand.pdbqt | data/1J/1JV1-UD1/1JV1-UD1_target.pdbqt | data/1J/1JV1-UD1/1JV1-UD1_decoys.pdbqt | data/1J/1JV1-UD1/1JV1-UD1_decoy_scores.csv |
1J1S-FMP | data/1J/1J1S-FMP/1J1S-FMP_ligand.pdbqt | data/1J/1J1S-FMP/1J1S-FMP_target.pdbqt | data/1J/1J1S-FMP/1J1S-FMP_decoys.pdbqt | data/1J/1J1S-FMP/1J1S-FMP_decoy_scores.csv |
1JVD-UD1 | data/1J/1JVD-UD1/1JVD-UD1_ligand.pdbqt | data/1J/1JVD-UD1/1JVD-UD1_target.pdbqt | data/1J/1JVD-UD1/1JVD-UD1_decoys.pdbqt | data/1J/1JVD-UD1/1JVD-UD1_decoy_scores.csv |
1J4R-001 | data/1J/1J4R-001/1J4R-001_ligand.pdbqt | data/1J/1J4R-001/1J4R-001_target.pdbqt | data/1J/1J4R-001/1J4R-001_decoys.pdbqt | data/1J/1J4R-001/1J4R-001_decoy_scores.csv |
1JRC-ORO | data/1J/1JRC-ORO/1JRC-ORO_ligand.pdbqt | data/1J/1JRC-ORO/1JRC-ORO_target.pdbqt | data/1J/1JRC-ORO/1JRC-ORO_decoys.pdbqt | data/1J/1JRC-ORO/1JRC-ORO_decoy_scores.csv |
1JG4-SAM | data/1J/1JG4-SAM/1JG4-SAM_ligand.pdbqt | data/1J/1JG4-SAM/1JG4-SAM_target.pdbqt | data/1J/1JG4-SAM/1JG4-SAM_decoys.pdbqt | data/1J/1JG4-SAM/1JG4-SAM_decoy_scores.csv |
1JEP-DFL | data/1J/1JEP-DFL/1JEP-DFL_ligand.pdbqt | data/1J/1JEP-DFL/1JEP-DFL_target.pdbqt | data/1J/1JEP-DFL/1JEP-DFL_decoys.pdbqt | data/1J/1JEP-DFL/1JEP-DFL_decoy_scores.csv |
1JVU-C2P | data/1J/1JVU-C2P/1JVU-C2P_ligand.pdbqt | data/1J/1JVU-C2P/1JVU-C2P_target.pdbqt | data/1J/1JVU-C2P/1JVU-C2P_decoys.pdbqt | data/1J/1JVU-C2P/1JVU-C2P_decoy_scores.csv |
1JOF-PIN | data/1J/1JOF-PIN/1JOF-PIN_ligand.pdbqt | data/1J/1JOF-PIN/1JOF-PIN_target.pdbqt | data/1J/1JOF-PIN/1JOF-PIN_decoys.pdbqt | data/1J/1JOF-PIN/1JOF-PIN_decoy_scores.csv |
1JG0-DDT | data/1J/1JG0-DDT/1JG0-DDT_ligand.pdbqt | data/1J/1JG0-DDT/1JG0-DDT_target.pdbqt | data/1J/1JG0-DDT/1JG0-DDT_decoys.pdbqt | data/1J/1JG0-DDT/1JG0-DDT_decoy_scores.csv |
1JZ4-2DG | data/1J/1JZ4-2DG/1JZ4-2DG_ligand.pdbqt | data/1J/1JZ4-2DG/1JZ4-2DG_target.pdbqt | data/1J/1JZ4-2DG/1JZ4-2DG_decoys.pdbqt | data/1J/1JZ4-2DG/1JZ4-2DG_decoy_scores.csv |
1JG9-GLC | data/1J/1JG9-GLC/1JG9-GLC_ligand.pdbqt | data/1J/1JG9-GLC/1JG9-GLC_target.pdbqt | data/1J/1JG9-GLC/1JG9-GLC_decoys.pdbqt | data/1J/1JG9-GLC/1JG9-GLC_decoy_scores.csv |
1JQE-QUN | data/1J/1JQE-QUN/1JQE-QUN_ligand.pdbqt | data/1J/1JQE-QUN/1JQE-QUN_target.pdbqt | data/1J/1JQE-QUN/1JQE-QUN_decoys.pdbqt | data/1J/1JQE-QUN/1JQE-QUN_decoy_scores.csv |
1JR0-A24 | data/1J/1JR0-A24/1JR0-A24_ligand.pdbqt | data/1J/1JR0-A24/1JR0-A24_target.pdbqt | data/1J/1JR0-A24/1JR0-A24_decoys.pdbqt | data/1J/1JR0-A24/1JR0-A24_decoy_scores.csv |
1JH8-ADE | data/1J/1JH8-ADE/1JH8-ADE_ligand.pdbqt | data/1J/1JH8-ADE/1JH8-ADE_target.pdbqt | data/1J/1JH8-ADE/1JH8-ADE_decoys.pdbqt | data/1J/1JH8-ADE/1JH8-ADE_decoy_scores.csv |
1JBO-CYC | data/1J/1JBO-CYC/1JBO-CYC_ligand.pdbqt | data/1J/1JBO-CYC/1JBO-CYC_target.pdbqt | data/1J/1JBO-CYC/1JBO-CYC_decoys.pdbqt | data/1J/1JBO-CYC/1JBO-CYC_decoy_scores.csv |
1J1Z-ATP | data/1J/1J1Z-ATP/1J1Z-ATP_ligand.pdbqt | data/1J/1J1Z-ATP/1J1Z-ATP_target.pdbqt | data/1J/1J1Z-ATP/1J1Z-ATP_decoys.pdbqt | data/1J/1J1Z-ATP/1J1Z-ATP_decoy_scores.csv |
1J2Z-SOG | data/1J/1J2Z-SOG/1J2Z-SOG_ligand.pdbqt | data/1J/1J2Z-SOG/1J2Z-SOG_target.pdbqt | data/1J/1J2Z-SOG/1J2Z-SOG_decoys.pdbqt | data/1J/1J2Z-SOG/1J2Z-SOG_decoy_scores.csv |
1J1A-BHP | data/1J/1J1A-BHP/1J1A-BHP_ligand.pdbqt | data/1J/1J1A-BHP/1J1A-BHP_target.pdbqt | data/1J/1J1A-BHP/1J1A-BHP_decoys.pdbqt | data/1J/1J1A-BHP/1J1A-BHP_decoy_scores.csv |
1JMG-UMP | data/1J/1JMG-UMP/1JMG-UMP_ligand.pdbqt | data/1J/1JMG-UMP/1JMG-UMP_target.pdbqt | data/1J/1JMG-UMP/1JMG-UMP_decoys.pdbqt | data/1J/1JMG-UMP/1JMG-UMP_decoy_scores.csv |
1J37-X8Z | data/1J/1J37-X8Z/1J37-X8Z_ligand.pdbqt | data/1J/1J37-X8Z/1J37-X8Z_target.pdbqt | data/1J/1J37-X8Z/1J37-X8Z_decoys.pdbqt | data/1J/1J37-X8Z/1J37-X8Z_decoy_scores.csv |
1JVJ-IM2 | data/1J/1JVJ-IM2/1JVJ-IM2_ligand.pdbqt | data/1J/1JVJ-IM2/1JVJ-IM2_target.pdbqt | data/1J/1JVJ-IM2/1JVJ-IM2_decoys.pdbqt | data/1J/1JVJ-IM2/1JVJ-IM2_decoy_scores.csv |
1J91-TBS | data/1J/1J91-TBS/1J91-TBS_ligand.pdbqt | data/1J/1J91-TBS/1J91-TBS_target.pdbqt | data/1J/1J91-TBS/1J91-TBS_decoys.pdbqt | data/1J/1J91-TBS/1J91-TBS_decoy_scores.csv |
1J01-XIL | data/1J/1J01-XIL/1J01-XIL_ligand.pdbqt | data/1J/1J01-XIL/1J01-XIL_target.pdbqt | data/1J/1J01-XIL/1J01-XIL_decoys.pdbqt | data/1J/1J01-XIL/1J01-XIL_decoy_scores.csv |
1JOM-FFO | data/1J/1JOM-FFO/1JOM-FFO_ligand.pdbqt | data/1J/1JOM-FFO/1JOM-FFO_target.pdbqt | data/1J/1JOM-FFO/1JOM-FFO_decoys.pdbqt | data/1J/1JOM-FFO/1JOM-FFO_decoy_scores.csv |
1J8Q-FMN | data/1J/1J8Q-FMN/1J8Q-FMN_ligand.pdbqt | data/1J/1J8Q-FMN/1J8Q-FMN_target.pdbqt | data/1J/1J8Q-FMN/1J8Q-FMN_decoys.pdbqt | data/1J/1J8Q-FMN/1J8Q-FMN_decoy_scores.csv |
1JLA-TNK | data/1J/1JLA-TNK/1JLA-TNK_ligand.pdbqt | data/1J/1JLA-TNK/1JLA-TNK_target.pdbqt | data/1J/1JLA-TNK/1JLA-TNK_decoys.pdbqt | data/1J/1JLA-TNK/1JLA-TNK_decoy_scores.csv |
1JCL-HPD | data/1J/1JCL-HPD/1JCL-HPD_ligand.pdbqt | data/1J/1JCL-HPD/1JCL-HPD_target.pdbqt | data/1J/1JCL-HPD/1JCL-HPD_decoys.pdbqt | data/1J/1JCL-HPD/1JCL-HPD_decoy_scores.csv |
1J36-LPR | data/1J/1J36-LPR/1J36-LPR_ligand.pdbqt | data/1J/1J36-LPR/1J36-LPR_target.pdbqt | data/1J/1J36-LPR/1J36-LPR_decoys.pdbqt | data/1J/1J36-LPR/1J36-LPR_decoy_scores.csv |
1J11-EPG | data/1J/1J11-EPG/1J11-EPG_ligand.pdbqt | data/1J/1J11-EPG/1J11-EPG_target.pdbqt | data/1J/1J11-EPG/1J11-EPG_decoys.pdbqt | data/1J/1J11-EPG/1J11-EPG_decoy_scores.csv |
1JLR-GTP | data/1J/1JLR-GTP/1JLR-GTP_ligand.pdbqt | data/1J/1JLR-GTP/1JLR-GTP_target.pdbqt | data/1J/1JLR-GTP/1JLR-GTP_decoys.pdbqt | data/1J/1JLR-GTP/1JLR-GTP_decoy_scores.csv |
1J9E-FMN | data/1J/1J9E-FMN/1J9E-FMN_ligand.pdbqt | data/1J/1J9E-FMN/1J9E-FMN_target.pdbqt | data/1J/1J9E-FMN/1J9E-FMN_decoys.pdbqt | data/1J/1J9E-FMN/1J9E-FMN_decoy_scores.csv |
1JOC-ITP | data/1J/1JOC-ITP/1JOC-ITP_ligand.pdbqt | data/1J/1JOC-ITP/1JOC-ITP_target.pdbqt | data/1J/1JOC-ITP/1JOC-ITP_decoys.pdbqt | data/1J/1JOC-ITP/1JOC-ITP_decoy_scores.csv |
1JKL-ANP | data/1J/1JKL-ANP/1JKL-ANP_ligand.pdbqt | data/1J/1JKL-ANP/1JKL-ANP_target.pdbqt | data/1J/1JKL-ANP/1JKL-ANP_decoys.pdbqt | data/1J/1JKL-ANP/1JKL-ANP_decoy_scores.csv |
1JSV-U55 | data/1J/1JSV-U55/1JSV-U55_ligand.pdbqt | data/1J/1JSV-U55/1JSV-U55_target.pdbqt | data/1J/1JSV-U55/1JSV-U55_decoys.pdbqt | data/1J/1JSV-U55/1JSV-U55_decoy_scores.csv |
1J99-AND | data/1J/1J99-AND/1J99-AND_ligand.pdbqt | data/1J/1J99-AND/1J99-AND_target.pdbqt | data/1J/1J99-AND/1J99-AND_decoys.pdbqt | data/1J/1J99-AND/1J99-AND_decoy_scores.csv |
1JKI-NAI | data/1J/1JKI-NAI/1JKI-NAI_ligand.pdbqt | data/1J/1JKI-NAI/1JKI-NAI_target.pdbqt | data/1J/1JKI-NAI/1JKI-NAI_decoys.pdbqt | data/1J/1JKI-NAI/1JKI-NAI_decoy_scores.csv |
1JGU-HBC | data/1J/1JGU-HBC/1JGU-HBC_ligand.pdbqt | data/1J/1JGU-HBC/1JGU-HBC_target.pdbqt | data/1J/1JGU-HBC/1JGU-HBC_decoys.pdbqt | data/1J/1JGU-HBC/1JGU-HBC_decoy_scores.csv |
1JQD-SAH | data/1J/1JQD-SAH/1JQD-SAH_ligand.pdbqt | data/1J/1JQD-SAH/1JQD-SAH_target.pdbqt | data/1J/1JQD-SAH/1JQD-SAH_decoys.pdbqt | data/1J/1JQD-SAH/1JQD-SAH_decoy_scores.csv |
1J53-TMP | data/1J/1J53-TMP/1J53-TMP_ligand.pdbqt | data/1J/1J53-TMP/1J53-TMP_target.pdbqt | data/1J/1J53-TMP/1J53-TMP_decoys.pdbqt | data/1J/1J53-TMP/1J53-TMP_decoy_scores.csv |
1J39-UPG | data/1J/1J39-UPG/1J39-UPG_ligand.pdbqt | data/1J/1J39-UPG/1J39-UPG_target.pdbqt | data/1J/1J39-UPG/1J39-UPG_decoys.pdbqt | data/1J/1J39-UPG/1J39-UPG_decoy_scores.csv |
1JE1-GMP | data/1J/1JE1-GMP/1JE1-GMP_ligand.pdbqt | data/1J/1JE1-GMP/1JE1-GMP_target.pdbqt | data/1J/1JE1-GMP/1JE1-GMP_decoys.pdbqt | data/1J/1JE1-GMP/1JE1-GMP_decoy_scores.csv |
1JG0-UMP | data/1J/1JG0-UMP/1JG0-UMP_ligand.pdbqt | data/1J/1JG0-UMP/1JG0-UMP_target.pdbqt | data/1J/1JG0-UMP/1JG0-UMP_decoys.pdbqt | data/1J/1JG0-UMP/1JG0-UMP_decoy_scores.csv |
1JI0-ATP | data/1J/1JI0-ATP/1JI0-ATP_ligand.pdbqt | data/1J/1JI0-ATP/1JI0-ATP_target.pdbqt | data/1J/1JI0-ATP/1JI0-ATP_decoys.pdbqt | data/1J/1JI0-ATP/1JI0-ATP_decoy_scores.csv |
1JV6-RET | data/1J/1JV6-RET/1JV6-RET_ligand.pdbqt | data/1J/1JV6-RET/1JV6-RET_target.pdbqt | data/1J/1JV6-RET/1JV6-RET_decoys.pdbqt | data/1J/1JV6-RET/1JV6-RET_decoy_scores.csv |
1JJE-BYS | data/1J/1JJE-BYS/1JJE-BYS_ligand.pdbqt | data/1J/1JJE-BYS/1JJE-BYS_target.pdbqt | data/1J/1JJE-BYS/1JJE-BYS_decoys.pdbqt | data/1J/1JJE-BYS/1JJE-BYS_decoy_scores.csv |
1JM6-ADP | data/1J/1JM6-ADP/1JM6-ADP_ligand.pdbqt | data/1J/1JM6-ADP/1JM6-ADP_target.pdbqt | data/1J/1JM6-ADP/1JM6-ADP_decoys.pdbqt | data/1J/1JM6-ADP/1JM6-ADP_decoy_scores.csv |
1JKK-ANP | data/1J/1JKK-ANP/1JKK-ANP_ligand.pdbqt | data/1J/1JKK-ANP/1JKK-ANP_target.pdbqt | data/1J/1JKK-ANP/1JKK-ANP_decoys.pdbqt | data/1J/1JKK-ANP/1JKK-ANP_decoy_scores.csv |
1JG6-UDP | data/1J/1JG6-UDP/1JG6-UDP_ligand.pdbqt | data/1J/1JG6-UDP/1JG6-UDP_target.pdbqt | data/1J/1JG6-UDP/1JG6-UDP_decoys.pdbqt | data/1J/1JG6-UDP/1JG6-UDP_decoy_scores.csv |
1J6Z-ADP | data/1J/1J6Z-ADP/1J6Z-ADP_ligand.pdbqt | data/1J/1J6Z-ADP/1J6Z-ADP_target.pdbqt | data/1J/1J6Z-ADP/1J6Z-ADP_decoys.pdbqt | data/1J/1J6Z-ADP/1J6Z-ADP_decoy_scores.csv |
1J7U-ANP | data/1J/1J7U-ANP/1J7U-ANP_ligand.pdbqt | data/1J/1J7U-ANP/1J7U-ANP_target.pdbqt | data/1J/1J7U-ANP/1J7U-ANP_decoys.pdbqt | data/1J/1J7U-ANP/1J7U-ANP_decoy_scores.csv |
1J3I-UMP | data/1J/1J3I-UMP/1J3I-UMP_ligand.pdbqt | data/1J/1J3I-UMP/1J3I-UMP_target.pdbqt | data/1J/1J3I-UMP/1J3I-UMP_decoys.pdbqt | data/1J/1J3I-UMP/1J3I-UMP_decoy_scores.csv |
1JZ3-BTB | data/1J/1JZ3-BTB/1JZ3-BTB_ligand.pdbqt | data/1J/1JZ3-BTB/1JZ3-BTB_target.pdbqt | data/1J/1JZ3-BTB/1JZ3-BTB_decoys.pdbqt | data/1J/1JZ3-BTB/1JZ3-BTB_decoy_scores.csv |
1JAI-GCP | data/1J/1JAI-GCP/1JAI-GCP_ligand.pdbqt | data/1J/1JAI-GCP/1JAI-GCP_target.pdbqt | data/1J/1JAI-GCP/1JAI-GCP_decoys.pdbqt | data/1J/1JAI-GCP/1JAI-GCP_decoy_scores.csv |
1JDV-ADN | data/1J/1JDV-ADN/1JDV-ADN_ligand.pdbqt | data/1J/1JDV-ADN/1JDV-ADN_target.pdbqt | data/1J/1JDV-ADN/1JDV-ADN_decoys.pdbqt | data/1J/1JDV-ADN/1JDV-ADN_decoy_scores.csv |
1J21-CIR | data/1J/1J21-CIR/1J21-CIR_ligand.pdbqt | data/1J/1J21-CIR/1J21-CIR_target.pdbqt | data/1J/1J21-CIR/1J21-CIR_decoys.pdbqt | data/1J/1J21-CIR/1J21-CIR_decoy_scores.csv |
1JQX-FMN | data/1J/1JQX-FMN/1JQX-FMN_ligand.pdbqt | data/1J/1JQX-FMN/1JQX-FMN_target.pdbqt | data/1J/1JQX-FMN/1JQX-FMN_decoys.pdbqt | data/1J/1JQX-FMN/1JQX-FMN_decoy_scores.csv |
1J14-BEN | data/1J/1J14-BEN/1J14-BEN_ligand.pdbqt | data/1J/1J14-BEN/1J14-BEN_target.pdbqt | data/1J/1J14-BEN/1J14-BEN_decoys.pdbqt | data/1J/1J14-BEN/1J14-BEN_decoy_scores.csv |
1JWK-HBI | data/1J/1JWK-HBI/1JWK-HBI_ligand.pdbqt | data/1J/1JWK-HBI/1JWK-HBI_target.pdbqt | data/1J/1JWK-HBI/1JWK-HBI_decoys.pdbqt | data/1J/1JWK-HBI/1JWK-HBI_decoy_scores.csv |
1J2J-GTP | data/1J/1J2J-GTP/1J2J-GTP_ligand.pdbqt | data/1J/1J2J-GTP/1J2J-GTP_target.pdbqt | data/1J/1J2J-GTP/1J2J-GTP_decoys.pdbqt | data/1J/1J2J-GTP/1J2J-GTP_decoy_scores.csv |
1JAK-IFG | data/1J/1JAK-IFG/1JAK-IFG_ligand.pdbqt | data/1J/1JAK-IFG/1JAK-IFG_target.pdbqt | data/1J/1JAK-IFG/1JAK-IFG_decoys.pdbqt | data/1J/1JAK-IFG/1JAK-IFG_decoy_scores.csv |
1J21-ATP | data/1J/1J21-ATP/1J21-ATP_ligand.pdbqt | data/1J/1J21-ATP/1J21-ATP_target.pdbqt | data/1J/1J21-ATP/1J21-ATP_decoys.pdbqt | data/1J/1J21-ATP/1J21-ATP_decoy_scores.csv |
1JBV-ACP | data/1J/1JBV-ACP/1JBV-ACP_ligand.pdbqt | data/1J/1JBV-ACP/1JBV-ACP_target.pdbqt | data/1J/1JBV-ACP/1JBV-ACP_decoys.pdbqt | data/1J/1JBV-ACP/1JBV-ACP_decoy_scores.csv |
1J78-VDY | data/1J/1J78-VDY/1J78-VDY_ligand.pdbqt | data/1J/1J78-VDY/1J78-VDY_target.pdbqt | data/1J/1J78-VDY/1J78-VDY_decoys.pdbqt | data/1J/1J78-VDY/1J78-VDY_decoy_scores.csv |
1JDJ-CFP | data/1J/1JDJ-CFP/1JDJ-CFP_ligand.pdbqt | data/1J/1JDJ-CFP/1JDJ-CFP_target.pdbqt | data/1J/1JDJ-CFP/1JDJ-CFP_decoys.pdbqt | data/1J/1JDJ-CFP/1JDJ-CFP_decoy_scores.csv |
Subsets and Splits
No community queries yet
The top public SQL queries from the community will appear here once available.