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 ⌀ |
|---|---|---|---|---|
5DL5-C8E | data/5D/5DL5-C8E/5DL5-C8E_ligand.pdbqt | data/5D/5DL5-C8E/5DL5-C8E_target.pdbqt | data/5D/5DL5-C8E/5DL5-C8E_decoys.pdbqt | data/5D/5DL5-C8E/5DL5-C8E_decoy_scores.csv |
5DAF-58E | data/5D/5DAF-58E/5DAF-58E_ligand.pdbqt | data/5D/5DAF-58E/5DAF-58E_target.pdbqt | data/5D/5DAF-58E/5DAF-58E_decoys.pdbqt | data/5D/5DAF-58E/5DAF-58E_decoy_scores.csv |
5DE1-59D | data/5D/5DE1-59D/5DE1-59D_ligand.pdbqt | data/5D/5DE1-59D/5DE1-59D_target.pdbqt | data/5D/5DE1-59D/5DE1-59D_decoys.pdbqt | data/5D/5DE1-59D/5DE1-59D_decoy_scores.csv |
5DWZ-MPO | data/5D/5DWZ-MPO/5DWZ-MPO_ligand.pdbqt | data/5D/5DWZ-MPO/5DWZ-MPO_target.pdbqt | data/5D/5DWZ-MPO/5DWZ-MPO_decoys.pdbqt | data/5D/5DWZ-MPO/5DWZ-MPO_decoy_scores.csv |
5DQF-LCR | data/5D/5DQF-LCR/5DQF-LCR_ligand.pdbqt | data/5D/5DQF-LCR/5DQF-LCR_target.pdbqt | data/5D/5DQF-LCR/5DQF-LCR_decoys.pdbqt | data/5D/5DQF-LCR/5DQF-LCR_decoy_scores.csv |
5DHU-5A8 | data/5D/5DHU-5A8/5DHU-5A8_ligand.pdbqt | data/5D/5DHU-5A8/5DHU-5A8_target.pdbqt | data/5D/5DHU-5A8/5DHU-5A8_decoys.pdbqt | data/5D/5DHU-5A8/5DHU-5A8_decoy_scores.csv |
5DR9-SKE | data/5D/5DR9-SKE/5DR9-SKE_ligand.pdbqt | data/5D/5DR9-SKE/5DR9-SKE_target.pdbqt | data/5D/5DR9-SKE/5DR9-SKE_decoys.pdbqt | data/5D/5DR9-SKE/5DR9-SKE_decoy_scores.csv |
5DTV-5FS | data/5D/5DTV-5FS/5DTV-5FS_ligand.pdbqt | data/5D/5DTV-5FS/5DTV-5FS_target.pdbqt | data/5D/5DTV-5FS/5DTV-5FS_decoys.pdbqt | data/5D/5DTV-5FS/5DTV-5FS_decoy_scores.csv |
5DW2-5GD | data/5D/5DW2-5GD/5DW2-5GD_ligand.pdbqt | data/5D/5DW2-5GD/5DW2-5GD_target.pdbqt | data/5D/5DW2-5GD/5DW2-5GD_decoys.pdbqt | data/5D/5DW2-5GD/5DW2-5GD_decoy_scores.csv |
5DEH-THP | data/5D/5DEH-THP/5DEH-THP_ligand.pdbqt | data/5D/5DEH-THP/5DEH-THP_target.pdbqt | data/5D/5DEH-THP/5DEH-THP_decoys.pdbqt | data/5D/5DEH-THP/5DEH-THP_decoy_scores.csv |
5DR2-5E1 | data/5D/5DR2-5E1/5DR2-5E1_ligand.pdbqt | data/5D/5DR2-5E1/5DR2-5E1_target.pdbqt | data/5D/5DR2-5E1/5DR2-5E1_decoys.pdbqt | data/5D/5DR2-5E1/5DR2-5E1_decoy_scores.csv |
5DPM-SAH | data/5D/5DPM-SAH/5DPM-SAH_ligand.pdbqt | data/5D/5DPM-SAH/5DPM-SAH_target.pdbqt | data/5D/5DPM-SAH/5DPM-SAH_decoys.pdbqt | data/5D/5DPM-SAH/5DPM-SAH_decoy_scores.csv |
5DP4-5E8 | data/5D/5DP4-5E8/5DP4-5E8_ligand.pdbqt | data/5D/5DP4-5E8/5DP4-5E8_target.pdbqt | data/5D/5DP4-5E8/5DP4-5E8_decoys.pdbqt | data/5D/5DP4-5E8/5DP4-5E8_decoy_scores.csv |
5DFC-EAM | data/5D/5DFC-EAM/5DFC-EAM_ligand.pdbqt | data/5D/5DFC-EAM/5DFC-EAM_target.pdbqt | data/5D/5DFC-EAM/5DFC-EAM_decoys.pdbqt | data/5D/5DFC-EAM/5DFC-EAM_decoy_scores.csv |
5DU8-5FK | data/5D/5DU8-5FK/5DU8-5FK_ligand.pdbqt | data/5D/5DU8-5FK/5DU8-5FK_target.pdbqt | data/5D/5DU8-5FK/5DU8-5FK_decoys.pdbqt | data/5D/5DU8-5FK/5DU8-5FK_decoy_scores.csv |
5DYJ-AMP | data/5D/5DYJ-AMP/5DYJ-AMP_ligand.pdbqt | data/5D/5DYJ-AMP/5DYJ-AMP_target.pdbqt | data/5D/5DYJ-AMP/5DYJ-AMP_decoys.pdbqt | data/5D/5DYJ-AMP/5DYJ-AMP_decoy_scores.csv |
5DX4-E0C | data/5D/5DX4-E0C/5DX4-E0C_ligand.pdbqt | data/5D/5DX4-E0C/5DX4-E0C_target.pdbqt | data/5D/5DX4-E0C/5DX4-E0C_decoys.pdbqt | data/5D/5DX4-E0C/5DX4-E0C_decoy_scores.csv |
5DDI-NAD | data/5D/5DDI-NAD/5DDI-NAD_ligand.pdbqt | data/5D/5DDI-NAD/5DDI-NAD_target.pdbqt | data/5D/5DDI-NAD/5DDI-NAD_decoys.pdbqt | data/5D/5DDI-NAD/5DDI-NAD_decoy_scores.csv |
5DCD-TYR | data/5D/5DCD-TYR/5DCD-TYR_ligand.pdbqt | data/5D/5DCD-TYR/5DCD-TYR_target.pdbqt | data/5D/5DCD-TYR/5DCD-TYR_decoys.pdbqt | data/5D/5DCD-TYR/5DCD-TYR_decoy_scores.csv |
5D9J-0N8 | data/5D/5D9J-0N8/5D9J-0N8_ligand.pdbqt | data/5D/5D9J-0N8/5D9J-0N8_target.pdbqt | data/5D/5D9J-0N8/5D9J-0N8_decoys.pdbqt | data/5D/5D9J-0N8/5D9J-0N8_decoy_scores.csv |
5DGJ-V64 | data/5D/5DGJ-V64/5DGJ-V64_ligand.pdbqt | data/5D/5DGJ-V64/5DGJ-V64_target.pdbqt | data/5D/5DGJ-V64/5DGJ-V64_decoys.pdbqt | data/5D/5DGJ-V64/5DGJ-V64_decoy_scores.csv |
5D0H-ATP | data/5D/5D0H-ATP/5D0H-ATP_ligand.pdbqt | data/5D/5D0H-ATP/5D0H-ATP_target.pdbqt | data/5D/5D0H-ATP/5D0H-ATP_decoys.pdbqt | data/5D/5D0H-ATP/5D0H-ATP_decoy_scores.csv |
5D13-LYS | data/5D/5D13-LYS/5D13-LYS_ligand.pdbqt | data/5D/5D13-LYS/5D13-LYS_target.pdbqt | data/5D/5D13-LYS/5D13-LYS_decoys.pdbqt | data/5D/5D13-LYS/5D13-LYS_decoy_scores.csv |
5D0G-GTP | data/5D/5D0G-GTP/5D0G-GTP_ligand.pdbqt | data/5D/5D0G-GTP/5D0G-GTP_target.pdbqt | data/5D/5D0G-GTP/5D0G-GTP_decoys.pdbqt | data/5D/5D0G-GTP/5D0G-GTP_decoy_scores.csv |
5DCB-PEP | data/5D/5DCB-PEP/5DCB-PEP_ligand.pdbqt | data/5D/5DCB-PEP/5DCB-PEP_target.pdbqt | data/5D/5DCB-PEP/5DCB-PEP_decoys.pdbqt | data/5D/5DCB-PEP/5DCB-PEP_decoy_scores.csv |
5DX0-SFG | data/5D/5DX0-SFG/5DX0-SFG_ligand.pdbqt | data/5D/5DX0-SFG/5DX0-SFG_target.pdbqt | data/5D/5DX0-SFG/5DX0-SFG_decoys.pdbqt | data/5D/5DX0-SFG/5DX0-SFG_decoy_scores.csv |
5D5E-PE5 | data/5D/5D5E-PE5/5D5E-PE5_ligand.pdbqt | data/5D/5D5E-PE5/5D5E-PE5_target.pdbqt | data/5D/5D5E-PE5/5D5E-PE5_decoys.pdbqt | data/5D/5D5E-PE5/5D5E-PE5_decoy_scores.csv |
5DUF-G7A | data/5D/5DUF-G7A/5DUF-G7A_ligand.pdbqt | data/5D/5DUF-G7A/5DUF-G7A_target.pdbqt | data/5D/5DUF-G7A/5DUF-G7A_decoys.pdbqt | data/5D/5DUF-G7A/5DUF-G7A_decoy_scores.csv |
5D6T-NGA | data/5D/5D6T-NGA/5D6T-NGA_ligand.pdbqt | data/5D/5D6T-NGA/5D6T-NGA_target.pdbqt | data/5D/5D6T-NGA/5D6T-NGA_decoys.pdbqt | data/5D/5D6T-NGA/5D6T-NGA_decoy_scores.csv |
5D6F-57R | data/5D/5D6F-57R/5D6F-57R_ligand.pdbqt | data/5D/5D6F-57R/5D6F-57R_target.pdbqt | data/5D/5D6F-57R/5D6F-57R_decoys.pdbqt | data/5D/5D6F-57R/5D6F-57R_decoy_scores.csv |
5DJR-5BK | data/5D/5DJR-5BK/5DJR-5BK_ligand.pdbqt | data/5D/5DJR-5BK/5DJR-5BK_target.pdbqt | data/5D/5DJR-5BK/5DJR-5BK_decoys.pdbqt | data/5D/5DJR-5BK/5DJR-5BK_decoy_scores.csv |
5D47-L19 | data/5D/5D47-L19/5D47-L19_ligand.pdbqt | data/5D/5D47-L19/5D47-L19_target.pdbqt | data/5D/5D47-L19/5D47-L19_decoys.pdbqt | data/5D/5D47-L19/5D47-L19_decoy_scores.csv |
5D6R-EN0 | data/5D/5D6R-EN0/5D6R-EN0_ligand.pdbqt | data/5D/5D6R-EN0/5D6R-EN0_target.pdbqt | data/5D/5D6R-EN0/5D6R-EN0_decoys.pdbqt | data/5D/5D6R-EN0/5D6R-EN0_decoy_scores.csv |
5DTM-5F4 | data/5D/5DTM-5F4/5DTM-5F4_ligand.pdbqt | data/5D/5DTM-5F4/5DTM-5F4_target.pdbqt | data/5D/5DTM-5F4/5DTM-5F4_decoys.pdbqt | data/5D/5DTM-5F4/5DTM-5F4_decoy_scores.csv |
5DLD-UDP | data/5D/5DLD-UDP/5DLD-UDP_ligand.pdbqt | data/5D/5DLD-UDP/5DLD-UDP_target.pdbqt | data/5D/5DLD-UDP/5DLD-UDP_decoys.pdbqt | data/5D/5DLD-UDP/5DLD-UDP_decoy_scores.csv |
5DWD-1PG | data/5D/5DWD-1PG/5DWD-1PG_ligand.pdbqt | data/5D/5DWD-1PG/5DWD-1PG_target.pdbqt | data/5D/5DWD-1PG/5DWD-1PG_decoys.pdbqt | data/5D/5DWD-1PG/5DWD-1PG_decoy_scores.csv |
5D3S-579 | data/5D/5D3S-579/5D3S-579_ligand.pdbqt | data/5D/5D3S-579/5D3S-579_target.pdbqt | data/5D/5D3S-579/5D3S-579_decoys.pdbqt | data/5D/5D3S-579/5D3S-579_decoy_scores.csv |
5DRB-5FJ | data/5D/5DRB-5FJ/5DRB-5FJ_ligand.pdbqt | data/5D/5DRB-5FJ/5DRB-5FJ_target.pdbqt | data/5D/5DRB-5FJ/5DRB-5FJ_decoys.pdbqt | data/5D/5DRB-5FJ/5DRB-5FJ_decoy_scores.csv |
5DUA-5FQ | data/5D/5DUA-5FQ/5DUA-5FQ_ligand.pdbqt | data/5D/5DUA-5FQ/5DUA-5FQ_target.pdbqt | data/5D/5DUA-5FQ/5DUA-5FQ_decoys.pdbqt | data/5D/5DUA-5FQ/5DUA-5FQ_decoy_scores.csv |
5D09-PEP | data/5D/5D09-PEP/5D09-PEP_ligand.pdbqt | data/5D/5D09-PEP/5D09-PEP_target.pdbqt | data/5D/5D09-PEP/5D09-PEP_decoys.pdbqt | data/5D/5D09-PEP/5D09-PEP_decoy_scores.csv |
5DLB-CXS | data/5D/5DLB-CXS/5DLB-CXS_ligand.pdbqt | data/5D/5DLB-CXS/5DLB-CXS_target.pdbqt | null | null |
5DLS-5CV | data/5D/5DLS-5CV/5DLS-5CV_ligand.pdbqt | data/5D/5DLS-5CV/5DLS-5CV_target.pdbqt | data/5D/5DLS-5CV/5DLS-5CV_decoys.pdbqt | data/5D/5DLS-5CV/5DLS-5CV_decoy_scores.csv |
5DCO-PLM | data/5D/5DCO-PLM/5DCO-PLM_ligand.pdbqt | data/5D/5DCO-PLM/5DCO-PLM_target.pdbqt | data/5D/5DCO-PLM/5DCO-PLM_decoys.pdbqt | data/5D/5DCO-PLM/5DCO-PLM_decoy_scores.csv |
5DAW-58K | data/5D/5DAW-58K/5DAW-58K_ligand.pdbqt | data/5D/5DAW-58K/5DAW-58K_target.pdbqt | data/5D/5DAW-58K/5DAW-58K_decoys.pdbqt | data/5D/5DAW-58K/5DAW-58K_decoy_scores.csv |
5DTT-5F5 | data/5D/5DTT-5F5/5DTT-5F5_ligand.pdbqt | data/5D/5DTT-5F5/5DTT-5F5_target.pdbqt | data/5D/5DTT-5F5/5DTT-5F5_decoys.pdbqt | data/5D/5DTT-5F5/5DTT-5F5_decoy_scores.csv |
5D00-GMT | data/5D/5D00-GMT/5D00-GMT_ligand.pdbqt | data/5D/5D00-GMT/5D00-GMT_target.pdbqt | data/5D/5D00-GMT/5D00-GMT_decoys.pdbqt | data/5D/5D00-GMT/5D00-GMT_decoy_scores.csv |
5D6P-57U | data/5D/5D6P-57U/5D6P-57U_ligand.pdbqt | data/5D/5D6P-57U/5D6P-57U_target.pdbqt | data/5D/5D6P-57U/5D6P-57U_decoys.pdbqt | data/5D/5D6P-57U/5D6P-57U_decoy_scores.csv |
5DJT-FMN | data/5D/5DJT-FMN/5DJT-FMN_ligand.pdbqt | data/5D/5DJT-FMN/5DJT-FMN_target.pdbqt | data/5D/5DJT-FMN/5DJT-FMN_decoys.pdbqt | data/5D/5DJT-FMN/5DJT-FMN_decoy_scores.csv |
5DYX-ADE | data/5D/5DYX-ADE/5DYX-ADE_ligand.pdbqt | data/5D/5DYX-ADE/5DYX-ADE_target.pdbqt | data/5D/5DYX-ADE/5DYX-ADE_decoys.pdbqt | data/5D/5DYX-ADE/5DYX-ADE_decoy_scores.csv |
5DHD-PE3 | data/5D/5DHD-PE3/5DHD-PE3_ligand.pdbqt | data/5D/5DHD-PE3/5DHD-PE3_target.pdbqt | data/5D/5DHD-PE3/5DHD-PE3_decoys.pdbqt | data/5D/5DHD-PE3/5DHD-PE3_decoy_scores.csv |
5D7X-XZ8 | data/5D/5D7X-XZ8/5D7X-XZ8_ligand.pdbqt | data/5D/5D7X-XZ8/5D7X-XZ8_target.pdbqt | data/5D/5D7X-XZ8/5D7X-XZ8_decoys.pdbqt | data/5D/5D7X-XZ8/5D7X-XZ8_decoy_scores.csv |
5DWQ-SFG | data/5D/5DWQ-SFG/5DWQ-SFG_ligand.pdbqt | data/5D/5DWQ-SFG/5DWQ-SFG_target.pdbqt | data/5D/5DWQ-SFG/5DWQ-SFG_decoys.pdbqt | data/5D/5DWQ-SFG/5DWQ-SFG_decoy_scores.csv |
5DPV-5DN | data/5D/5DPV-5DN/5DPV-5DN_ligand.pdbqt | data/5D/5DPV-5DN/5DPV-5DN_target.pdbqt | data/5D/5DPV-5DN/5DPV-5DN_decoys.pdbqt | data/5D/5DPV-5DN/5DPV-5DN_decoy_scores.csv |
5DIG-5CE | data/5D/5DIG-5CE/5DIG-5CE_ligand.pdbqt | data/5D/5DIG-5CE/5DIG-5CE_target.pdbqt | data/5D/5DIG-5CE/5DIG-5CE_decoys.pdbqt | data/5D/5DIG-5CE/5DIG-5CE_decoy_scores.csv |
5DKR-5CZ | data/5D/5DKR-5CZ/5DKR-5CZ_ligand.pdbqt | data/5D/5DKR-5CZ/5DKR-5CZ_target.pdbqt | data/5D/5DKR-5CZ/5DKR-5CZ_decoys.pdbqt | data/5D/5DKR-5CZ/5DKR-5CZ_decoy_scores.csv |
5DM0-5D8 | data/5D/5DM0-5D8/5DM0-5D8_ligand.pdbqt | data/5D/5DM0-5D8/5DM0-5D8_target.pdbqt | data/5D/5DM0-5D8/5DM0-5D8_decoys.pdbqt | data/5D/5DM0-5D8/5DM0-5D8_decoy_scores.csv |
5D85-P1T | data/5D/5D85-P1T/5D85-P1T_ligand.pdbqt | data/5D/5D85-P1T/5D85-P1T_target.pdbqt | data/5D/5D85-P1T/5D85-P1T_decoys.pdbqt | data/5D/5D85-P1T/5D85-P1T_decoy_scores.csv |
5DFX-CYC | data/5D/5DFX-CYC/5DFX-CYC_ligand.pdbqt | data/5D/5DFX-CYC/5DFX-CYC_target.pdbqt | data/5D/5DFX-CYC/5DFX-CYC_decoys.pdbqt | data/5D/5DFX-CYC/5DFX-CYC_decoy_scores.csv |
5D7O-AR6 | data/5D/5D7O-AR6/5D7O-AR6_ligand.pdbqt | data/5D/5D7O-AR6/5D7O-AR6_target.pdbqt | data/5D/5D7O-AR6/5D7O-AR6_decoys.pdbqt | data/5D/5D7O-AR6/5D7O-AR6_decoy_scores.csv |
5D75-JEF | data/5D/5D75-JEF/5D75-JEF_ligand.pdbqt | data/5D/5D75-JEF/5D75-JEF_target.pdbqt | data/5D/5D75-JEF/5D75-JEF_decoys.pdbqt | data/5D/5D75-JEF/5D75-JEF_decoy_scores.csv |
5D3N-L40 | data/5D/5D3N-L40/5D3N-L40_ligand.pdbqt | data/5D/5D3N-L40/5D3N-L40_target.pdbqt | data/5D/5D3N-L40/5D3N-L40_decoys.pdbqt | data/5D/5D3N-L40/5D3N-L40_decoy_scores.csv |
5DR4-5GQ | data/5D/5DR4-5GQ/5DR4-5GQ_ligand.pdbqt | data/5D/5DR4-5GQ/5DR4-5GQ_target.pdbqt | data/5D/5DR4-5GQ/5DR4-5GQ_decoys.pdbqt | data/5D/5DR4-5GQ/5DR4-5GQ_decoy_scores.csv |
5D5D-78M | data/5D/5D5D-78M/5D5D-78M_ligand.pdbqt | data/5D/5D5D-78M/5D5D-78M_target.pdbqt | data/5D/5D5D-78M/5D5D-78M_decoys.pdbqt | data/5D/5D5D-78M/5D5D-78M_decoy_scores.csv |
5D48-L96 | data/5D/5D48-L96/5D48-L96_ligand.pdbqt | data/5D/5D48-L96/5D48-L96_target.pdbqt | data/5D/5D48-L96/5D48-L96_decoys.pdbqt | data/5D/5D48-L96/5D48-L96_decoy_scores.csv |
5D0R-B1T | data/5D/5D0R-B1T/5D0R-B1T_ligand.pdbqt | data/5D/5D0R-B1T/5D0R-B1T_target.pdbqt | data/5D/5D0R-B1T/5D0R-B1T_decoys.pdbqt | data/5D/5D0R-B1T/5D0R-B1T_decoy_scores.csv |
5DB2-58R | data/5D/5DB2-58R/5DB2-58R_ligand.pdbqt | data/5D/5DB2-58R/5DB2-58R_target.pdbqt | data/5D/5DB2-58R/5DB2-58R_decoys.pdbqt | data/5D/5DB2-58R/5DB2-58R_decoy_scores.csv |
5DZT-AMP | data/5D/5DZT-AMP/5DZT-AMP_ligand.pdbqt | data/5D/5DZT-AMP/5DZT-AMP_target.pdbqt | data/5D/5DZT-AMP/5DZT-AMP_decoys.pdbqt | data/5D/5DZT-AMP/5DZT-AMP_decoy_scores.csv |
5DO8-BTB | data/5D/5DO8-BTB/5DO8-BTB_ligand.pdbqt | data/5D/5DO8-BTB/5DO8-BTB_target.pdbqt | data/5D/5DO8-BTB/5DO8-BTB_decoys.pdbqt | data/5D/5DO8-BTB/5DO8-BTB_decoy_scores.csv |
5DBE-OAS | data/5D/5DBE-OAS/5DBE-OAS_ligand.pdbqt | data/5D/5DBE-OAS/5DBE-OAS_target.pdbqt | data/5D/5DBE-OAS/5DBE-OAS_decoys.pdbqt | data/5D/5DBE-OAS/5DBE-OAS_decoy_scores.csv |
5D69-57T | data/5D/5D69-57T/5D69-57T_ligand.pdbqt | data/5D/5D69-57T/5D69-57T_target.pdbqt | data/5D/5D69-57T/5D69-57T_decoys.pdbqt | data/5D/5D69-57T/5D69-57T_decoy_scores.csv |
5DXA-SFG | data/5D/5DXA-SFG/5DXA-SFG_ligand.pdbqt | data/5D/5DXA-SFG/5DXA-SFG_target.pdbqt | data/5D/5DXA-SFG/5DXA-SFG_decoys.pdbqt | data/5D/5DXA-SFG/5DXA-SFG_decoy_scores.csv |
5D1J-56H | data/5D/5D1J-56H/5D1J-56H_ligand.pdbqt | data/5D/5D1J-56H/5D1J-56H_target.pdbqt | data/5D/5D1J-56H/5D1J-56H_decoys.pdbqt | data/5D/5D1J-56H/5D1J-56H_decoy_scores.csv |
5DGW-5B5 | data/5D/5DGW-5B5/5DGW-5B5_ligand.pdbqt | data/5D/5DGW-5B5/5DGW-5B5_target.pdbqt | data/5D/5DGW-5B5/5DGW-5B5_decoys.pdbqt | data/5D/5DGW-5B5/5DGW-5B5_decoy_scores.csv |
5DRN-5CT | data/5D/5DRN-5CT/5DRN-5CT_ligand.pdbqt | data/5D/5DRN-5CT/5DRN-5CT_target.pdbqt | data/5D/5DRN-5CT/5DRN-5CT_decoys.pdbqt | data/5D/5DRN-5CT/5DRN-5CT_decoy_scores.csv |
5DRK-ADP | data/5D/5DRK-ADP/5DRK-ADP_ligand.pdbqt | data/5D/5DRK-ADP/5DRK-ADP_target.pdbqt | data/5D/5DRK-ADP/5DRK-ADP_decoys.pdbqt | data/5D/5DRK-ADP/5DRK-ADP_decoy_scores.csv |
5DPX-L3B | data/5D/5DPX-L3B/5DPX-L3B_ligand.pdbqt | data/5D/5DPX-L3B/5DPX-L3B_target.pdbqt | data/5D/5DPX-L3B/5DPX-L3B_decoys.pdbqt | data/5D/5DPX-L3B/5DPX-L3B_decoy_scores.csv |
5D2B-56O | data/5D/5D2B-56O/5D2B-56O_ligand.pdbqt | data/5D/5D2B-56O/5D2B-56O_target.pdbqt | data/5D/5D2B-56O/5D2B-56O_decoys.pdbqt | data/5D/5D2B-56O/5D2B-56O_decoy_scores.csv |
5DI9-GNP | data/5D/5DI9-GNP/5DI9-GNP_ligand.pdbqt | data/5D/5DI9-GNP/5DI9-GNP_target.pdbqt | data/5D/5DI9-GNP/5DI9-GNP_decoys.pdbqt | data/5D/5DI9-GNP/5DI9-GNP_decoy_scores.csv |
5DKY-NOJ | data/5D/5DKY-NOJ/5DKY-NOJ_ligand.pdbqt | data/5D/5DKY-NOJ/5DKY-NOJ_target.pdbqt | data/5D/5DKY-NOJ/5DKY-NOJ_decoys.pdbqt | data/5D/5DKY-NOJ/5DKY-NOJ_decoy_scores.csv |
5DN3-5DN | data/5D/5DN3-5DN/5DN3-5DN_ligand.pdbqt | data/5D/5DN3-5DN/5DN3-5DN_target.pdbqt | data/5D/5DN3-5DN/5DN3-5DN_decoys.pdbqt | data/5D/5DN3-5DN/5DN3-5DN_decoy_scores.csv |
5DM2-5D9 | data/5D/5DM2-5D9/5DM2-5D9_ligand.pdbqt | data/5D/5DM2-5D9/5DM2-5D9_target.pdbqt | data/5D/5DM2-5D9/5DM2-5D9_decoys.pdbqt | data/5D/5DM2-5D9/5DM2-5D9_decoy_scores.csv |
5DOG-BCN | data/5D/5DOG-BCN/5DOG-BCN_ligand.pdbqt | data/5D/5DOG-BCN/5DOG-BCN_target.pdbqt | data/5D/5DOG-BCN/5DOG-BCN_decoys.pdbqt | data/5D/5DOG-BCN/5DOG-BCN_decoy_scores.csv |
5DY9-AMP | data/5D/5DY9-AMP/5DY9-AMP_ligand.pdbqt | data/5D/5DY9-AMP/5DY9-AMP_target.pdbqt | data/5D/5DY9-AMP/5DY9-AMP_decoys.pdbqt | data/5D/5DY9-AMP/5DY9-AMP_decoy_scores.csv |
5D4O-AMP | data/5D/5D4O-AMP/5D4O-AMP_ligand.pdbqt | data/5D/5D4O-AMP/5D4O-AMP_target.pdbqt | data/5D/5D4O-AMP/5D4O-AMP_decoys.pdbqt | data/5D/5D4O-AMP/5D4O-AMP_decoy_scores.csv |
5D7J-2LJ | data/5D/5D7J-2LJ/5D7J-2LJ_ligand.pdbqt | data/5D/5D7J-2LJ/5D7J-2LJ_target.pdbqt | data/5D/5D7J-2LJ/5D7J-2LJ_decoys.pdbqt | data/5D/5D7J-2LJ/5D7J-2LJ_decoy_scores.csv |
5DA3-58V | data/5D/5DA3-58V/5DA3-58V_ligand.pdbqt | data/5D/5DA3-58V/5DA3-58V_target.pdbqt | data/5D/5DA3-58V/5DA3-58V_decoys.pdbqt | data/5D/5DA3-58V/5DA3-58V_decoy_scores.csv |
5DP7-5EC | data/5D/5DP7-5EC/5DP7-5EC_ligand.pdbqt | data/5D/5DP7-5EC/5DP7-5EC_target.pdbqt | data/5D/5DP7-5EC/5DP7-5EC_decoys.pdbqt | data/5D/5DP7-5EC/5DP7-5EC_decoy_scores.csv |
5DDD-59X | data/5D/5DDD-59X/5DDD-59X_ligand.pdbqt | data/5D/5DDD-59X/5DDD-59X_target.pdbqt | data/5D/5DDD-59X/5DDD-59X_decoys.pdbqt | data/5D/5DDD-59X/5DDD-59X_decoy_scores.csv |
5DOG-5DT | data/5D/5DOG-5DT/5DOG-5DT_ligand.pdbqt | data/5D/5DOG-5DT/5DOG-5DT_target.pdbqt | data/5D/5DOG-5DT/5DOG-5DT_decoys.pdbqt | data/5D/5DOG-5DT/5DOG-5DT_decoy_scores.csv |
5D7P-OCZ | data/5D/5D7P-OCZ/5D7P-OCZ_ligand.pdbqt | data/5D/5D7P-OCZ/5D7P-OCZ_target.pdbqt | data/5D/5D7P-OCZ/5D7P-OCZ_decoys.pdbqt | data/5D/5D7P-OCZ/5D7P-OCZ_decoy_scores.csv |
5DZ1-5JY | data/5D/5DZ1-5JY/5DZ1-5JY_ligand.pdbqt | data/5D/5DZ1-5JY/5DZ1-5JY_target.pdbqt | data/5D/5DZ1-5JY/5DZ1-5JY_decoys.pdbqt | data/5D/5DZ1-5JY/5DZ1-5JY_decoy_scores.csv |
5DIC-PLM | data/5D/5DIC-PLM/5DIC-PLM_ligand.pdbqt | data/5D/5DIC-PLM/5DIC-PLM_target.pdbqt | data/5D/5DIC-PLM/5DIC-PLM_decoys.pdbqt | data/5D/5DIC-PLM/5DIC-PLM_decoy_scores.csv |
5DQC-5E7 | data/5D/5DQC-5E7/5DQC-5E7_ligand.pdbqt | data/5D/5DQC-5E7/5DQC-5E7_target.pdbqt | data/5D/5DQC-5E7/5DQC-5E7_decoys.pdbqt | data/5D/5DQC-5E7/5DQC-5E7_decoy_scores.csv |
5DVC-T53 | data/5D/5DVC-T53/5DVC-T53_ligand.pdbqt | data/5D/5DVC-T53/5DVC-T53_target.pdbqt | data/5D/5DVC-T53/5DVC-T53_decoys.pdbqt | data/5D/5DVC-T53/5DVC-T53_decoy_scores.csv |
5D4P-ADP | data/5D/5D4P-ADP/5D4P-ADP_ligand.pdbqt | data/5D/5D4P-ADP/5D4P-ADP_target.pdbqt | data/5D/5D4P-ADP/5D4P-ADP_decoys.pdbqt | data/5D/5D4P-ADP/5D4P-ADP_decoy_scores.csv |
5DOH-5DU | data/5D/5DOH-5DU/5DOH-5DU_ligand.pdbqt | data/5D/5DOH-5DU/5DOH-5DU_target.pdbqt | data/5D/5DOH-5DU/5DOH-5DU_decoys.pdbqt | data/5D/5DOH-5DU/5DOH-5DU_decoy_scores.csv |
5DI3-GNP | data/5D/5DI3-GNP/5DI3-GNP_ligand.pdbqt | data/5D/5DI3-GNP/5DI3-GNP_target.pdbqt | data/5D/5DI3-GNP/5DI3-GNP_decoys.pdbqt | data/5D/5DI3-GNP/5DI3-GNP_decoy_scores.csv |
5DMH-ADP | data/5D/5DMH-ADP/5DMH-ADP_ligand.pdbqt | data/5D/5DMH-ADP/5DMH-ADP_target.pdbqt | data/5D/5DMH-ADP/5DMH-ADP_decoys.pdbqt | data/5D/5DMH-ADP/5DMH-ADP_decoy_scores.csv |
5D58-78M | data/5D/5D58-78M/5D58-78M_ligand.pdbqt | data/5D/5D58-78M/5D58-78M_target.pdbqt | data/5D/5D58-78M/5D58-78M_decoys.pdbqt | data/5D/5D58-78M/5D58-78M_decoy_scores.csv |
5DP3-5GH | data/5D/5DP3-5GH/5DP3-5GH_ligand.pdbqt | data/5D/5DP3-5GH/5DP3-5GH_target.pdbqt | data/5D/5DP3-5GH/5DP3-5GH_decoys.pdbqt | data/5D/5DP3-5GH/5DP3-5GH_decoy_scores.csv |
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