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 ⌀ |
|---|---|---|---|---|
6BC3-SIS | data/6B/6BC3-SIS/6BC3-SIS_ligand.pdbqt | data/6B/6BC3-SIS/6BC3-SIS_target.pdbqt | data/6B/6BC3-SIS/6BC3-SIS_decoys.pdbqt | data/6B/6BC3-SIS/6BC3-SIS_decoy_scores.csv |
6BTI-E7Y | data/6B/6BTI-E7Y/6BTI-E7Y_ligand.pdbqt | data/6B/6BTI-E7Y/6BTI-E7Y_target.pdbqt | data/6B/6BTI-E7Y/6BTI-E7Y_decoys.pdbqt | data/6B/6BTI-E7Y/6BTI-E7Y_decoy_scores.csv |
6B37-CGD | data/6B/6B37-CGD/6B37-CGD_ligand.pdbqt | data/6B/6B37-CGD/6B37-CGD_target.pdbqt | data/6B/6B37-CGD/6B37-CGD_decoys.pdbqt | data/6B/6B37-CGD/6B37-CGD_decoy_scores.csv |
6BB3-D4A | data/6B/6BB3-D4A/6BB3-D4A_ligand.pdbqt | data/6B/6BB3-D4A/6BB3-D4A_target.pdbqt | data/6B/6BB3-D4A/6BB3-D4A_decoys.pdbqt | data/6B/6BB3-D4A/6BB3-D4A_decoy_scores.csv |
6B1X-C9D | data/6B/6B1X-C9D/6B1X-C9D_ligand.pdbqt | data/6B/6B1X-C9D/6B1X-C9D_target.pdbqt | data/6B/6B1X-C9D/6B1X-C9D_decoys.pdbqt | data/6B/6B1X-C9D/6B1X-C9D_decoy_scores.csv |
6BRF-GTP | data/6B/6BRF-GTP/6BRF-GTP_ligand.pdbqt | data/6B/6BRF-GTP/6BRF-GTP_target.pdbqt | data/6B/6BRF-GTP/6BRF-GTP_decoys.pdbqt | data/6B/6BRF-GTP/6BRF-GTP_decoy_scores.csv |
6BFY-2PG | data/6B/6BFY-2PG/6BFY-2PG_ligand.pdbqt | data/6B/6BFY-2PG/6BFY-2PG_target.pdbqt | data/6B/6BFY-2PG/6BFY-2PG_decoys.pdbqt | data/6B/6BFY-2PG/6BFY-2PG_decoy_scores.csv |
6BDN-ADP | data/6B/6BDN-ADP/6BDN-ADP_ligand.pdbqt | data/6B/6BDN-ADP/6BDN-ADP_target.pdbqt | data/6B/6BDN-ADP/6BDN-ADP_decoys.pdbqt | data/6B/6BDN-ADP/6BDN-ADP_decoy_scores.csv |
6BFG-FMN | data/6B/6BFG-FMN/6BFG-FMN_ligand.pdbqt | data/6B/6BFG-FMN/6BFG-FMN_target.pdbqt | data/6B/6BFG-FMN/6BFG-FMN_decoys.pdbqt | data/6B/6BFG-FMN/6BFG-FMN_decoy_scores.csv |
6BLD-DXJ | data/6B/6BLD-DXJ/6BLD-DXJ_ligand.pdbqt | data/6B/6BLD-DXJ/6BLD-DXJ_target.pdbqt | data/6B/6BLD-DXJ/6BLD-DXJ_decoys.pdbqt | data/6B/6BLD-DXJ/6BLD-DXJ_decoy_scores.csv |
6BOI-E0Y | data/6B/6BOI-E0Y/6BOI-E0Y_ligand.pdbqt | data/6B/6BOI-E0Y/6BOI-E0Y_target.pdbqt | data/6B/6BOI-E0Y/6BOI-E0Y_decoys.pdbqt | data/6B/6BOI-E0Y/6BOI-E0Y_decoy_scores.csv |
6BSL-EVV | data/6B/6BSL-EVV/6BSL-EVV_ligand.pdbqt | data/6B/6BSL-EVV/6BSL-EVV_target.pdbqt | data/6B/6BSL-EVV/6BSL-EVV_decoys.pdbqt | data/6B/6BSL-EVV/6BSL-EVV_decoy_scores.csv |
6B4U-CN7 | data/6B/6B4U-CN7/6B4U-CN7_ligand.pdbqt | data/6B/6B4U-CN7/6B4U-CN7_target.pdbqt | data/6B/6B4U-CN7/6B4U-CN7_decoys.pdbqt | data/6B/6B4U-CN7/6B4U-CN7_decoy_scores.csv |
6BVK-GNP | data/6B/6BVK-GNP/6BVK-GNP_ligand.pdbqt | data/6B/6BVK-GNP/6BVK-GNP_target.pdbqt | data/6B/6BVK-GNP/6BVK-GNP_decoys.pdbqt | data/6B/6BVK-GNP/6BVK-GNP_decoy_scores.csv |
6B4Y-A3P | data/6B/6B4Y-A3P/6B4Y-A3P_ligand.pdbqt | data/6B/6B4Y-A3P/6B4Y-A3P_target.pdbqt | data/6B/6B4Y-A3P/6B4Y-A3P_decoys.pdbqt | data/6B/6B4Y-A3P/6B4Y-A3P_decoy_scores.csv |
6BJO-DUY | data/6B/6BJO-DUY/6BJO-DUY_ligand.pdbqt | data/6B/6BJO-DUY/6BJO-DUY_target.pdbqt | data/6B/6BJO-DUY/6BJO-DUY_decoys.pdbqt | data/6B/6BJO-DUY/6BJO-DUY_decoy_scores.csv |
6BDS-DJ4 | data/6B/6BDS-DJ4/6BDS-DJ4_ligand.pdbqt | data/6B/6BDS-DJ4/6BDS-DJ4_target.pdbqt | data/6B/6BDS-DJ4/6BDS-DJ4_decoys.pdbqt | data/6B/6BDS-DJ4/6BDS-DJ4_decoy_scores.csv |
6BHS-IHP | data/6B/6BHS-IHP/6BHS-IHP_ligand.pdbqt | data/6B/6BHS-IHP/6BHS-IHP_target.pdbqt | data/6B/6BHS-IHP/6BHS-IHP_decoys.pdbqt | data/6B/6BHS-IHP/6BHS-IHP_decoy_scores.csv |
6BAO-BLR | data/6B/6BAO-BLR/6BAO-BLR_ligand.pdbqt | data/6B/6BAO-BLR/6BAO-BLR_target.pdbqt | data/6B/6BAO-BLR/6BAO-BLR_decoys.pdbqt | data/6B/6BAO-BLR/6BAO-BLR_decoy_scores.csv |
6B6P-XYS | data/6B/6B6P-XYS/6B6P-XYS_ligand.pdbqt | data/6B/6B6P-XYS/6B6P-XYS_target.pdbqt | data/6B/6B6P-XYS/6B6P-XYS_decoys.pdbqt | data/6B/6B6P-XYS/6B6P-XYS_decoy_scores.csv |
6B04-C6J | data/6B/6B04-C6J/6B04-C6J_ligand.pdbqt | data/6B/6B04-C6J/6B04-C6J_target.pdbqt | data/6B/6B04-C6J/6B04-C6J_decoys.pdbqt | data/6B/6B04-C6J/6B04-C6J_decoy_scores.csv |
6B69-9F2 | data/6B/6B69-9F2/6B69-9F2_ligand.pdbqt | data/6B/6B69-9F2/6B69-9F2_target.pdbqt | data/6B/6B69-9F2/6B69-9F2_decoys.pdbqt | data/6B/6B69-9F2/6B69-9F2_decoy_scores.csv |
6B8S-FMN | data/6B/6B8S-FMN/6B8S-FMN_ligand.pdbqt | data/6B/6B8S-FMN/6B8S-FMN_target.pdbqt | data/6B/6B8S-FMN/6B8S-FMN_decoys.pdbqt | data/6B/6B8S-FMN/6B8S-FMN_decoy_scores.csv |
6B81-OCA | data/6B/6B81-OCA/6B81-OCA_ligand.pdbqt | data/6B/6B81-OCA/6B81-OCA_target.pdbqt | data/6B/6B81-OCA/6B81-OCA_decoys.pdbqt | data/6B/6B81-OCA/6B81-OCA_decoy_scores.csv |
6BXI-ANP | data/6B/6BXI-ANP/6BXI-ANP_ligand.pdbqt | data/6B/6BXI-ANP/6BXI-ANP_target.pdbqt | data/6B/6BXI-ANP/6BXI-ANP_decoys.pdbqt | data/6B/6BXI-ANP/6BXI-ANP_decoy_scores.csv |
6BK3-B2S | data/6B/6BK3-B2S/6BK3-B2S_ligand.pdbqt | data/6B/6BK3-B2S/6BK3-B2S_target.pdbqt | data/6B/6BK3-B2S/6BK3-B2S_decoys.pdbqt | data/6B/6BK3-B2S/6BK3-B2S_decoy_scores.csv |
6B6O-XYP | data/6B/6B6O-XYP/6B6O-XYP_ligand.pdbqt | data/6B/6B6O-XYP/6B6O-XYP_target.pdbqt | data/6B/6B6O-XYP/6B6O-XYP_decoys.pdbqt | data/6B/6B6O-XYP/6B6O-XYP_decoy_scores.csv |
6B79-ORA | data/6B/6B79-ORA/6B79-ORA_ligand.pdbqt | data/6B/6B79-ORA/6B79-ORA_target.pdbqt | data/6B/6B79-ORA/6B79-ORA_decoys.pdbqt | data/6B/6B79-ORA/6B79-ORA_decoy_scores.csv |
6BCY-PE4 | data/6B/6BCY-PE4/6BCY-PE4_ligand.pdbqt | data/6B/6BCY-PE4/6BCY-PE4_target.pdbqt | data/6B/6BCY-PE4/6BCY-PE4_decoys.pdbqt | data/6B/6BCY-PE4/6BCY-PE4_decoy_scores.csv |
6B5H-NAD | data/6B/6B5H-NAD/6B5H-NAD_ligand.pdbqt | data/6B/6B5H-NAD/6B5H-NAD_target.pdbqt | data/6B/6B5H-NAD/6B5H-NAD_decoys.pdbqt | data/6B/6B5H-NAD/6B5H-NAD_decoy_scores.csv |
6BDR-DF7 | data/6B/6BDR-DF7/6BDR-DF7_ligand.pdbqt | data/6B/6BDR-DF7/6BDR-DF7_target.pdbqt | null | null |
6B8B-CZJ | data/6B/6B8B-CZJ/6B8B-CZJ_ligand.pdbqt | data/6B/6B8B-CZJ/6B8B-CZJ_target.pdbqt | data/6B/6B8B-CZJ/6B8B-CZJ_decoys.pdbqt | data/6B/6B8B-CZJ/6B8B-CZJ_decoy_scores.csv |
6BL8-PVB | data/6B/6BL8-PVB/6BL8-PVB_ligand.pdbqt | data/6B/6BL8-PVB/6BL8-PVB_target.pdbqt | data/6B/6BL8-PVB/6BL8-PVB_decoys.pdbqt | data/6B/6BL8-PVB/6BL8-PVB_decoy_scores.csv |
6B7R-NHE | data/6B/6B7R-NHE/6B7R-NHE_ligand.pdbqt | data/6B/6B7R-NHE/6B7R-NHE_target.pdbqt | data/6B/6B7R-NHE/6B7R-NHE_decoys.pdbqt | data/6B/6B7R-NHE/6B7R-NHE_decoy_scores.csv |
6BTN-E8M | data/6B/6BTN-E8M/6BTN-E8M_ligand.pdbqt | data/6B/6BTN-E8M/6BTN-E8M_target.pdbqt | data/6B/6BTN-E8M/6BTN-E8M_decoys.pdbqt | data/6B/6BTN-E8M/6BTN-E8M_decoy_scores.csv |
6B39-SAH | data/6B/6B39-SAH/6B39-SAH_ligand.pdbqt | data/6B/6B39-SAH/6B39-SAH_target.pdbqt | data/6B/6B39-SAH/6B39-SAH_decoys.pdbqt | data/6B/6B39-SAH/6B39-SAH_decoy_scores.csv |
6BH0-DO1 | data/6B/6BH0-DO1/6BH0-DO1_ligand.pdbqt | data/6B/6BH0-DO1/6BH0-DO1_target.pdbqt | data/6B/6BH0-DO1/6BH0-DO1_decoys.pdbqt | data/6B/6BH0-DO1/6BH0-DO1_decoy_scores.csv |
6B0Y-GDP | data/6B/6B0Y-GDP/6B0Y-GDP_ligand.pdbqt | data/6B/6B0Y-GDP/6B0Y-GDP_target.pdbqt | data/6B/6B0Y-GDP/6B0Y-GDP_decoys.pdbqt | data/6B/6B0Y-GDP/6B0Y-GDP_decoy_scores.csv |
6B6R-BEN | data/6B/6B6R-BEN/6B6R-BEN_ligand.pdbqt | data/6B/6B6R-BEN/6B6R-BEN_target.pdbqt | data/6B/6B6R-BEN/6B6R-BEN_decoys.pdbqt | data/6B/6B6R-BEN/6B6R-BEN_decoy_scores.csv |
6BCC-EZL | data/6B/6BCC-EZL/6BCC-EZL_ligand.pdbqt | data/6B/6BCC-EZL/6BCC-EZL_target.pdbqt | null | null |
6B0K-G4S | data/6B/6B0K-G4S/6B0K-G4S_ligand.pdbqt | data/6B/6B0K-G4S/6B0K-G4S_target.pdbqt | data/6B/6B0K-G4S/6B0K-G4S_decoys.pdbqt | data/6B/6B0K-G4S/6B0K-G4S_decoy_scores.csv |
6BKH-DVD | data/6B/6BKH-DVD/6BKH-DVD_ligand.pdbqt | data/6B/6BKH-DVD/6BKH-DVD_target.pdbqt | data/6B/6BKH-DVD/6BKH-DVD_decoys.pdbqt | data/6B/6BKH-DVD/6BKH-DVD_decoy_scores.csv |
6BP0-E1D | data/6B/6BP0-E1D/6BP0-E1D_ligand.pdbqt | data/6B/6BP0-E1D/6BP0-E1D_target.pdbqt | data/6B/6BP0-E1D/6BP0-E1D_decoys.pdbqt | data/6B/6BP0-E1D/6BP0-E1D_decoy_scores.csv |
6B59-CQS | data/6B/6B59-CQS/6B59-CQS_ligand.pdbqt | data/6B/6B59-CQS/6B59-CQS_target.pdbqt | data/6B/6B59-CQS/6B59-CQS_decoys.pdbqt | data/6B/6B59-CQS/6B59-CQS_decoy_scores.csv |
6BD8-D81 | data/6B/6BD8-D81/6BD8-D81_ligand.pdbqt | data/6B/6BD8-D81/6BD8-D81_target.pdbqt | data/6B/6BD8-D81/6BD8-D81_decoys.pdbqt | data/6B/6BD8-D81/6BD8-D81_decoy_scores.csv |
6B6O-BEN | data/6B/6B6O-BEN/6B6O-BEN_ligand.pdbqt | data/6B/6B6O-BEN/6B6O-BEN_target.pdbqt | data/6B/6B6O-BEN/6B6O-BEN_decoys.pdbqt | data/6B/6B6O-BEN/6B6O-BEN_decoy_scores.csv |
6BY8-FNV | data/6B/6BY8-FNV/6BY8-FNV_ligand.pdbqt | data/6B/6BY8-FNV/6BY8-FNV_target.pdbqt | data/6B/6BY8-FNV/6BY8-FNV_decoys.pdbqt | data/6B/6BY8-FNV/6BY8-FNV_decoy_scores.csv |
6B6U-B3P | data/6B/6B6U-B3P/6B6U-B3P_ligand.pdbqt | data/6B/6B6U-B3P/6B6U-B3P_target.pdbqt | data/6B/6B6U-B3P/6B6U-B3P_decoys.pdbqt | data/6B/6B6U-B3P/6B6U-B3P_decoy_scores.csv |
6B99-NEC | data/6B/6B99-NEC/6B99-NEC_ligand.pdbqt | data/6B/6B99-NEC/6B99-NEC_target.pdbqt | data/6B/6B99-NEC/6B99-NEC_decoys.pdbqt | data/6B/6B99-NEC/6B99-NEC_decoy_scores.csv |
6BFH-KAN | data/6B/6BFH-KAN/6BFH-KAN_ligand.pdbqt | data/6B/6BFH-KAN/6BFH-KAN_target.pdbqt | data/6B/6BFH-KAN/6BFH-KAN_decoys.pdbqt | data/6B/6BFH-KAN/6BFH-KAN_decoy_scores.csv |
6BC0-GSP | data/6B/6BC0-GSP/6BC0-GSP_ligand.pdbqt | data/6B/6BC0-GSP/6BC0-GSP_target.pdbqt | data/6B/6BC0-GSP/6BC0-GSP_decoys.pdbqt | data/6B/6BC0-GSP/6BC0-GSP_decoy_scores.csv |
6BL1-DWG | data/6B/6BL1-DWG/6BL1-DWG_ligand.pdbqt | data/6B/6BL1-DWG/6BL1-DWG_target.pdbqt | data/6B/6BL1-DWG/6BL1-DWG_decoys.pdbqt | data/6B/6BL1-DWG/6BL1-DWG_decoy_scores.csv |
6BNR-E0J | data/6B/6BNR-E0J/6BNR-E0J_ligand.pdbqt | data/6B/6BNR-E0J/6BNR-E0J_target.pdbqt | data/6B/6BNR-E0J/6BNR-E0J_decoys.pdbqt | data/6B/6BNR-E0J/6BNR-E0J_decoy_scores.csv |
6BOZ-E1J | data/6B/6BOZ-E1J/6BOZ-E1J_ligand.pdbqt | data/6B/6BOZ-E1J/6BOZ-E1J_target.pdbqt | data/6B/6BOZ-E1J/6BOZ-E1J_decoys.pdbqt | data/6B/6BOZ-E1J/6BOZ-E1J_decoy_scores.csv |
6B66-GLU | data/6B/6B66-GLU/6B66-GLU_ligand.pdbqt | data/6B/6B66-GLU/6B66-GLU_target.pdbqt | data/6B/6B66-GLU/6B66-GLU_decoys.pdbqt | data/6B/6B66-GLU/6B66-GLU_decoy_scores.csv |
6B8R-THP | data/6B/6B8R-THP/6B8R-THP_ligand.pdbqt | data/6B/6B8R-THP/6B8R-THP_target.pdbqt | data/6B/6B8R-THP/6B8R-THP_decoys.pdbqt | data/6B/6B8R-THP/6B8R-THP_decoy_scores.csv |
6BTQ-E8S | data/6B/6BTQ-E8S/6BTQ-E8S_ligand.pdbqt | data/6B/6BTQ-E8S/6BTQ-E8S_target.pdbqt | data/6B/6BTQ-E8S/6BTQ-E8S_decoys.pdbqt | data/6B/6BTQ-E8S/6BTQ-E8S_decoy_scores.csv |
6B3V-7DQ | data/6B/6B3V-7DQ/6B3V-7DQ_ligand.pdbqt | data/6B/6B3V-7DQ/6B3V-7DQ_target.pdbqt | data/6B/6B3V-7DQ/6B3V-7DQ_decoys.pdbqt | data/6B/6B3V-7DQ/6B3V-7DQ_decoy_scores.csv |
6BSX-E7S | data/6B/6BSX-E7S/6BSX-E7S_ligand.pdbqt | data/6B/6BSX-E7S/6BSX-E7S_target.pdbqt | data/6B/6BSX-E7S/6BSX-E7S_decoys.pdbqt | data/6B/6BSX-E7S/6BSX-E7S_decoy_scores.csv |
6BMN-PAP | data/6B/6BMN-PAP/6BMN-PAP_ligand.pdbqt | data/6B/6BMN-PAP/6BMN-PAP_target.pdbqt | data/6B/6BMN-PAP/6BMN-PAP_decoys.pdbqt | data/6B/6BMN-PAP/6BMN-PAP_decoy_scores.csv |
6BVL-EBY | data/6B/6BVL-EBY/6BVL-EBY_ligand.pdbqt | data/6B/6BVL-EBY/6BVL-EBY_target.pdbqt | data/6B/6BVL-EBY/6BVL-EBY_decoys.pdbqt | data/6B/6BVL-EBY/6BVL-EBY_decoy_scores.csv |
6BKZ-DWM | data/6B/6BKZ-DWM/6BKZ-DWM_ligand.pdbqt | data/6B/6BKZ-DWM/6BKZ-DWM_target.pdbqt | data/6B/6BKZ-DWM/6BKZ-DWM_decoys.pdbqt | data/6B/6BKZ-DWM/6BKZ-DWM_decoy_scores.csv |
6B42-D5M | data/6B/6B42-D5M/6B42-D5M_ligand.pdbqt | data/6B/6B42-D5M/6B42-D5M_target.pdbqt | data/6B/6B42-D5M/6B42-D5M_decoys.pdbqt | data/6B/6B42-D5M/6B42-D5M_decoy_scores.csv |
6B4N-G53 | data/6B/6B4N-G53/6B4N-G53_ligand.pdbqt | data/6B/6B4N-G53/6B4N-G53_target.pdbqt | data/6B/6B4N-G53/6B4N-G53_decoys.pdbqt | data/6B/6B4N-G53/6B4N-G53_decoy_scores.csv |
6BL0-ICT | data/6B/6BL0-ICT/6BL0-ICT_ligand.pdbqt | data/6B/6BL0-ICT/6BL0-ICT_target.pdbqt | data/6B/6BL0-ICT/6BL0-ICT_decoys.pdbqt | data/6B/6BL0-ICT/6BL0-ICT_decoy_scores.csv |
6B7O-AR6 | data/6B/6B7O-AR6/6B7O-AR6_ligand.pdbqt | data/6B/6B7O-AR6/6B7O-AR6_target.pdbqt | data/6B/6B7O-AR6/6B7O-AR6_decoys.pdbqt | data/6B/6B7O-AR6/6B7O-AR6_decoy_scores.csv |
6B3C-CKS | data/6B/6B3C-CKS/6B3C-CKS_ligand.pdbqt | data/6B/6B3C-CKS/6B3C-CKS_target.pdbqt | data/6B/6B3C-CKS/6B3C-CKS_decoys.pdbqt | data/6B/6B3C-CKS/6B3C-CKS_decoy_scores.csv |
6BE0-IHP | data/6B/6BE0-IHP/6BE0-IHP_ligand.pdbqt | data/6B/6BE0-IHP/6BE0-IHP_target.pdbqt | data/6B/6BE0-IHP/6BE0-IHP_decoys.pdbqt | data/6B/6BE0-IHP/6BE0-IHP_decoy_scores.csv |
6B6A-9F2 | data/6B/6B6A-9F2/6B6A-9F2_ligand.pdbqt | data/6B/6B6A-9F2/6B6A-9F2_target.pdbqt | data/6B/6B6A-9F2/6B6A-9F2_decoys.pdbqt | data/6B/6B6A-9F2/6B6A-9F2_decoy_scores.csv |
6BAG-D0V | data/6B/6BAG-D0V/6BAG-D0V_ligand.pdbqt | data/6B/6BAG-D0V/6BAG-D0V_target.pdbqt | data/6B/6BAG-D0V/6BAG-D0V_decoys.pdbqt | data/6B/6BAG-D0V/6BAG-D0V_decoy_scores.csv |
6B18-C8A | data/6B/6B18-C8A/6B18-C8A_ligand.pdbqt | data/6B/6B18-C8A/6B18-C8A_target.pdbqt | data/6B/6B18-C8A/6B18-C8A_decoys.pdbqt | data/6B/6B18-C8A/6B18-C8A_decoy_scores.csv |
6BD4-OLC | data/6B/6BD4-OLC/6BD4-OLC_ligand.pdbqt | data/6B/6BD4-OLC/6BD4-OLC_target.pdbqt | data/6B/6BD4-OLC/6BD4-OLC_decoys.pdbqt | data/6B/6BD4-OLC/6BD4-OLC_decoy_scores.csv |
6BVM-GNP | data/6B/6BVM-GNP/6BVM-GNP_ligand.pdbqt | data/6B/6BVM-GNP/6BVM-GNP_target.pdbqt | data/6B/6BVM-GNP/6BVM-GNP_decoys.pdbqt | data/6B/6BVM-GNP/6BVM-GNP_decoy_scores.csv |
6BMB-SKM | data/6B/6BMB-SKM/6BMB-SKM_ligand.pdbqt | data/6B/6BMB-SKM/6BMB-SKM_target.pdbqt | data/6B/6BMB-SKM/6BMB-SKM_decoys.pdbqt | data/6B/6BMB-SKM/6BMB-SKM_decoy_scores.csv |
6BY2-F09 | data/6B/6BY2-F09/6BY2-F09_ligand.pdbqt | data/6B/6BY2-F09/6BY2-F09_target.pdbqt | data/6B/6BY2-F09/6BY2-F09_decoys.pdbqt | data/6B/6BY2-F09/6BY2-F09_decoy_scores.csv |
6BB2-NAD | data/6B/6BB2-NAD/6BB2-NAD_ligand.pdbqt | data/6B/6BB2-NAD/6BB2-NAD_target.pdbqt | data/6B/6BB2-NAD/6BB2-NAD_decoys.pdbqt | data/6B/6BB2-NAD/6BB2-NAD_decoy_scores.csv |
6B4D-53X | data/6B/6B4D-53X/6B4D-53X_ligand.pdbqt | data/6B/6B4D-53X/6B4D-53X_target.pdbqt | data/6B/6B4D-53X/6B4D-53X_decoys.pdbqt | data/6B/6B4D-53X/6B4D-53X_decoy_scores.csv |
6BVL-GNP | data/6B/6BVL-GNP/6BVL-GNP_ligand.pdbqt | data/6B/6BVL-GNP/6BVL-GNP_target.pdbqt | data/6B/6BVL-GNP/6BVL-GNP_decoys.pdbqt | data/6B/6BVL-GNP/6BVL-GNP_decoy_scores.csv |
6BD5-D7M | data/6B/6BD5-D7M/6BD5-D7M_ligand.pdbqt | data/6B/6BD5-D7M/6BD5-D7M_target.pdbqt | data/6B/6BD5-D7M/6BD5-D7M_decoys.pdbqt | data/6B/6BD5-D7M/6BD5-D7M_decoy_scores.csv |
6BFN-DL1 | data/6B/6BFN-DL1/6BFN-DL1_ligand.pdbqt | data/6B/6BFN-DL1/6BFN-DL1_target.pdbqt | data/6B/6BFN-DL1/6BFN-DL1_decoys.pdbqt | data/6B/6BFN-DL1/6BFN-DL1_decoy_scores.csv |
6BU0-O4B | data/6B/6BU0-O4B/6BU0-O4B_ligand.pdbqt | data/6B/6BU0-O4B/6BU0-O4B_target.pdbqt | data/6B/6BU0-O4B/6BU0-O4B_decoys.pdbqt | data/6B/6BU0-O4B/6BU0-O4B_decoy_scores.csv |
6B7D-CWG | data/6B/6B7D-CWG/6B7D-CWG_ligand.pdbqt | data/6B/6B7D-CWG/6B7D-CWG_target.pdbqt | data/6B/6B7D-CWG/6B7D-CWG_decoys.pdbqt | data/6B/6B7D-CWG/6B7D-CWG_decoy_scores.csv |
6BR1-E3Y | data/6B/6BR1-E3Y/6BR1-E3Y_ligand.pdbqt | data/6B/6BR1-E3Y/6BR1-E3Y_target.pdbqt | data/6B/6BR1-E3Y/6BR1-E3Y_decoys.pdbqt | data/6B/6BR1-E3Y/6BR1-E3Y_decoy_scores.csv |
6BBZ-SIS | data/6B/6BBZ-SIS/6BBZ-SIS_ligand.pdbqt | data/6B/6BBZ-SIS/6BBZ-SIS_target.pdbqt | data/6B/6BBZ-SIS/6BBZ-SIS_decoys.pdbqt | data/6B/6BBZ-SIS/6BBZ-SIS_decoy_scores.csv |
6BMM-OLB | data/6B/6BMM-OLB/6BMM-OLB_ligand.pdbqt | data/6B/6BMM-OLB/6BMM-OLB_target.pdbqt | data/6B/6BMM-OLB/6BMM-OLB_decoys.pdbqt | data/6B/6BMM-OLB/6BMM-OLB_decoy_scores.csv |
6BQ6-TER | data/6B/6BQ6-TER/6BQ6-TER_ligand.pdbqt | data/6B/6BQ6-TER/6BQ6-TER_target.pdbqt | data/6B/6BQ6-TER/6BQ6-TER_decoys.pdbqt | data/6B/6BQ6-TER/6BQ6-TER_decoy_scores.csv |
6BCS-BEN | data/6B/6BCS-BEN/6BCS-BEN_ligand.pdbqt | data/6B/6BCS-BEN/6BCS-BEN_target.pdbqt | data/6B/6BCS-BEN/6BCS-BEN_decoys.pdbqt | data/6B/6BCS-BEN/6BCS-BEN_decoy_scores.csv |
6BR1-ACP | data/6B/6BR1-ACP/6BR1-ACP_ligand.pdbqt | data/6B/6BR1-ACP/6BR1-ACP_target.pdbqt | data/6B/6BR1-ACP/6BR1-ACP_decoys.pdbqt | data/6B/6BR1-ACP/6BR1-ACP_decoy_scores.csv |
6BDQ-DE7 | data/6B/6BDQ-DE7/6BDQ-DE7_ligand.pdbqt | data/6B/6BDQ-DE7/6BDQ-DE7_target.pdbqt | data/6B/6BDQ-DE7/6BDQ-DE7_decoys.pdbqt | data/6B/6BDQ-DE7/6BDQ-DE7_decoy_scores.csv |
6B1W-C8V | data/6B/6B1W-C8V/6B1W-C8V_ligand.pdbqt | data/6B/6B1W-C8V/6B1W-C8V_target.pdbqt | data/6B/6B1W-C8V/6B1W-C8V_decoys.pdbqt | data/6B/6B1W-C8V/6B1W-C8V_decoy_scores.csv |
6BVJ-GNP | data/6B/6BVJ-GNP/6BVJ-GNP_ligand.pdbqt | data/6B/6BVJ-GNP/6BVJ-GNP_target.pdbqt | data/6B/6BVJ-GNP/6BVJ-GNP_decoys.pdbqt | data/6B/6BVJ-GNP/6BVJ-GNP_decoy_scores.csv |
6B4X-A3P | data/6B/6B4X-A3P/6B4X-A3P_ligand.pdbqt | data/6B/6B4X-A3P/6B4X-A3P_target.pdbqt | null | null |
6BMQ-QIC | data/6B/6BMQ-QIC/6BMQ-QIC_ligand.pdbqt | data/6B/6BMQ-QIC/6BMQ-QIC_target.pdbqt | data/6B/6BMQ-QIC/6BMQ-QIC_decoys.pdbqt | data/6B/6BMQ-QIC/6BMQ-QIC_decoy_scores.csv |
6BZG-P6G | data/6B/6BZG-P6G/6BZG-P6G_ligand.pdbqt | data/6B/6BZG-P6G/6BZG-P6G_target.pdbqt | data/6B/6BZG-P6G/6BZG-P6G_decoys.pdbqt | data/6B/6BZG-P6G/6BZG-P6G_decoy_scores.csv |
6BXM-SAM | data/6B/6BXM-SAM/6BXM-SAM_ligand.pdbqt | data/6B/6BXM-SAM/6BXM-SAM_target.pdbqt | data/6B/6BXM-SAM/6BXM-SAM_decoys.pdbqt | data/6B/6BXM-SAM/6BXM-SAM_decoy_scores.csv |
6B36-CKD | data/6B/6B36-CKD/6B36-CKD_ligand.pdbqt | data/6B/6B36-CKD/6B36-CKD_target.pdbqt | data/6B/6B36-CKD/6B36-CKD_decoys.pdbqt | data/6B/6B36-CKD/6B36-CKD_decoy_scores.csv |
6BXW-APR | data/6B/6BXW-APR/6BXW-APR_ligand.pdbqt | data/6B/6BXW-APR/6BXW-APR_target.pdbqt | data/6B/6BXW-APR/6BXW-APR_decoys.pdbqt | data/6B/6BXW-APR/6BXW-APR_decoy_scores.csv |
6BGC-BGC | data/6B/6BGC-BGC/6BGC-BGC_ligand.pdbqt | data/6B/6BGC-BGC/6BGC-BGC_target.pdbqt | data/6B/6BGC-BGC/6BGC-BGC_decoys.pdbqt | data/6B/6BGC-BGC/6BGC-BGC_decoy_scores.csv |
6BIK-DTJ | data/6B/6BIK-DTJ/6BIK-DTJ_ligand.pdbqt | data/6B/6BIK-DTJ/6BIK-DTJ_target.pdbqt | data/6B/6BIK-DTJ/6BIK-DTJ_decoys.pdbqt | data/6B/6BIK-DTJ/6BIK-DTJ_decoy_scores.csv |
6BRF-GDP | data/6B/6BRF-GDP/6BRF-GDP_ligand.pdbqt | data/6B/6BRF-GDP/6BRF-GDP_target.pdbqt | data/6B/6BRF-GDP/6BRF-GDP_decoys.pdbqt | data/6B/6BRF-GDP/6BRF-GDP_decoy_scores.csv |
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