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 ⌀ |
|---|---|---|---|---|
4NS3-NAD | data/4N/4NS3-NAD/4NS3-NAD_ligand.pdbqt | data/4N/4NS3-NAD/4NS3-NAD_target.pdbqt | data/4N/4NS3-NAD/4NS3-NAD_decoys.pdbqt | data/4N/4NS3-NAD/4NS3-NAD_decoy_scores.csv |
4NMY-VIB | data/4N/4NMY-VIB/4NMY-VIB_ligand.pdbqt | data/4N/4NMY-VIB/4NMY-VIB_target.pdbqt | data/4N/4NMY-VIB/4NMY-VIB_decoys.pdbqt | data/4N/4NMY-VIB/4NMY-VIB_decoy_scores.csv |
4N1U-2GE | data/4N/4N1U-2GE/4N1U-2GE_ligand.pdbqt | data/4N/4N1U-2GE/4N1U-2GE_target.pdbqt | data/4N/4N1U-2GE/4N1U-2GE_decoys.pdbqt | data/4N/4N1U-2GE/4N1U-2GE_decoy_scores.csv |
4NUW-U5P | data/4N/4NUW-U5P/4NUW-U5P_ligand.pdbqt | data/4N/4NUW-U5P/4NUW-U5P_target.pdbqt | data/4N/4NUW-U5P/4NUW-U5P_decoys.pdbqt | data/4N/4NUW-U5P/4NUW-U5P_decoy_scores.csv |
4NJI-2K8 | data/4N/4NJI-2K8/4NJI-2K8_ligand.pdbqt | data/4N/4NJI-2K8/4NJI-2K8_target.pdbqt | data/4N/4NJI-2K8/4NJI-2K8_decoys.pdbqt | data/4N/4NJI-2K8/4NJI-2K8_decoy_scores.csv |
4N7C-AEF | data/4N/4N7C-AEF/4N7C-AEF_ligand.pdbqt | data/4N/4N7C-AEF/4N7C-AEF_target.pdbqt | data/4N/4N7C-AEF/4N7C-AEF_decoys.pdbqt | data/4N/4N7C-AEF/4N7C-AEF_decoy_scores.csv |
4NF4-2JK | data/4N/4NF4-2JK/4NF4-2JK_ligand.pdbqt | data/4N/4NF4-2JK/4NF4-2JK_target.pdbqt | data/4N/4NF4-2JK/4NF4-2JK_decoys.pdbqt | data/4N/4NF4-2JK/4NF4-2JK_decoy_scores.csv |
4NAH-AGS | data/4N/4NAH-AGS/4NAH-AGS_ligand.pdbqt | data/4N/4NAH-AGS/4NAH-AGS_target.pdbqt | data/4N/4NAH-AGS/4NAH-AGS_decoys.pdbqt | data/4N/4NAH-AGS/4NAH-AGS_decoy_scores.csv |
4N93-PRP | data/4N/4N93-PRP/4N93-PRP_ligand.pdbqt | data/4N/4N93-PRP/4N93-PRP_target.pdbqt | data/4N/4N93-PRP/4N93-PRP_decoys.pdbqt | data/4N/4N93-PRP/4N93-PRP_decoy_scores.csv |
4NFE-BEN | data/4N/4NFE-BEN/4NFE-BEN_ligand.pdbqt | data/4N/4NFE-BEN/4NFE-BEN_target.pdbqt | data/4N/4NFE-BEN/4NFE-BEN_decoys.pdbqt | data/4N/4NFE-BEN/4NFE-BEN_decoy_scores.csv |
4N11-MPO | data/4N/4N11-MPO/4N11-MPO_ligand.pdbqt | data/4N/4N11-MPO/4N11-MPO_target.pdbqt | null | null |
4NEC-QUI | data/4N/4NEC-QUI/4NEC-QUI_ligand.pdbqt | data/4N/4NEC-QUI/4NEC-QUI_target.pdbqt | data/4N/4NEC-QUI/4NEC-QUI_decoys.pdbqt | data/4N/4NEC-QUI/4NEC-QUI_decoy_scores.csv |
4NQM-Y1Z | data/4N/4NQM-Y1Z/4NQM-Y1Z_ligand.pdbqt | data/4N/4NQM-Y1Z/4NQM-Y1Z_target.pdbqt | data/4N/4NQM-Y1Z/4NQM-Y1Z_decoys.pdbqt | data/4N/4NQM-Y1Z/4NQM-Y1Z_decoy_scores.csv |
4N16-CHD | data/4N/4N16-CHD/4N16-CHD_ligand.pdbqt | data/4N/4N16-CHD/4N16-CHD_target.pdbqt | data/4N/4N16-CHD/4N16-CHD_decoys.pdbqt | data/4N/4N16-CHD/4N16-CHD_decoy_scores.csv |
4NQN-Y1Z | data/4N/4NQN-Y1Z/4NQN-Y1Z_ligand.pdbqt | data/4N/4NQN-Y1Z/4NQN-Y1Z_target.pdbqt | data/4N/4NQN-Y1Z/4NQN-Y1Z_decoys.pdbqt | data/4N/4NQN-Y1Z/4NQN-Y1Z_decoy_scores.csv |
4NRU-2NG | data/4N/4NRU-2NG/4NRU-2NG_ligand.pdbqt | data/4N/4NRU-2NG/4NRU-2NG_target.pdbqt | data/4N/4NRU-2NG/4NRU-2NG_decoys.pdbqt | data/4N/4NRU-2NG/4NRU-2NG_decoy_scores.csv |
4N94-2HO | data/4N/4N94-2HO/4N94-2HO_ligand.pdbqt | data/4N/4N94-2HO/4N94-2HO_target.pdbqt | data/4N/4N94-2HO/4N94-2HO_decoys.pdbqt | data/4N/4N94-2HO/4N94-2HO_decoy_scores.csv |
4ND4-NAD | data/4N/4ND4-NAD/4ND4-NAD_ligand.pdbqt | data/4N/4ND4-NAD/4ND4-NAD_target.pdbqt | data/4N/4ND4-NAD/4ND4-NAD_decoys.pdbqt | data/4N/4ND4-NAD/4ND4-NAD_decoy_scores.csv |
4NB4-SH3 | data/4N/4NB4-SH3/4NB4-SH3_ligand.pdbqt | data/4N/4NB4-SH3/4NB4-SH3_target.pdbqt | data/4N/4NB4-SH3/4NB4-SH3_decoys.pdbqt | data/4N/4NB4-SH3/4NB4-SH3_decoy_scores.csv |
4NMZ-THP | data/4N/4NMZ-THP/4NMZ-THP_ligand.pdbqt | data/4N/4NMZ-THP/4NMZ-THP_target.pdbqt | data/4N/4NMZ-THP/4NMZ-THP_decoys.pdbqt | data/4N/4NMZ-THP/4NMZ-THP_decoy_scores.csv |
4NDR-ATP | data/4N/4NDR-ATP/4NDR-ATP_ligand.pdbqt | data/4N/4NDR-ATP/4NDR-ATP_target.pdbqt | null | null |
4NKT-2KH | data/4N/4NKT-2KH/4NKT-2KH_ligand.pdbqt | data/4N/4NKT-2KH/4NKT-2KH_target.pdbqt | data/4N/4NKT-2KH/4NKT-2KH_decoys.pdbqt | data/4N/4NKT-2KH/4NKT-2KH_decoy_scores.csv |
4NDN-SAM | data/4N/4NDN-SAM/4NDN-SAM_ligand.pdbqt | data/4N/4NDN-SAM/4NDN-SAM_target.pdbqt | data/4N/4NDN-SAM/4NDN-SAM_decoys.pdbqt | data/4N/4NDN-SAM/4NDN-SAM_decoy_scores.csv |
4N04-NHE | data/4N/4N04-NHE/4N04-NHE_ligand.pdbqt | data/4N/4N04-NHE/4N04-NHE_target.pdbqt | data/4N/4N04-NHE/4N04-NHE_decoys.pdbqt | data/4N/4N04-NHE/4N04-NHE_decoy_scores.csv |
4NBL-2J6 | data/4N/4NBL-2J6/4NBL-2J6_ligand.pdbqt | data/4N/4NBL-2J6/4NBL-2J6_target.pdbqt | data/4N/4NBL-2J6/4NBL-2J6_decoys.pdbqt | data/4N/4NBL-2J6/4NBL-2J6_decoy_scores.csv |
4NLL-FMN | data/4N/4NLL-FMN/4NLL-FMN_ligand.pdbqt | data/4N/4NLL-FMN/4NLL-FMN_target.pdbqt | data/4N/4NLL-FMN/4NLL-FMN_decoys.pdbqt | data/4N/4NLL-FMN/4NLL-FMN_decoy_scores.csv |
4NXV-GDP | data/4N/4NXV-GDP/4NXV-GDP_ligand.pdbqt | data/4N/4NXV-GDP/4NXV-GDP_target.pdbqt | data/4N/4NXV-GDP/4NXV-GDP_decoys.pdbqt | data/4N/4NXV-GDP/4NXV-GDP_decoy_scores.csv |
4NJS-G08 | data/4N/4NJS-G08/4NJS-G08_ligand.pdbqt | data/4N/4NJS-G08/4NJS-G08_target.pdbqt | data/4N/4NJS-G08/4NJS-G08_decoys.pdbqt | data/4N/4NJS-G08/4NJS-G08_decoy_scores.csv |
4NJ4-UN9 | data/4N/4NJ4-UN9/4NJ4-UN9_ligand.pdbqt | data/4N/4NJ4-UN9/4NJ4-UN9_target.pdbqt | data/4N/4NJ4-UN9/4NJ4-UN9_decoys.pdbqt | data/4N/4NJ4-UN9/4NJ4-UN9_decoy_scores.csv |
4NQE-2L4 | data/4N/4NQE-2L4/4NQE-2L4_ligand.pdbqt | data/4N/4NQE-2L4/4NQE-2L4_target.pdbqt | data/4N/4NQE-2L4/4NQE-2L4_decoys.pdbqt | data/4N/4NQE-2L4/4NQE-2L4_decoy_scores.csv |
4NYW-2O3 | data/4N/4NYW-2O3/4NYW-2O3_ligand.pdbqt | data/4N/4NYW-2O3/4NYW-2O3_target.pdbqt | data/4N/4NYW-2O3/4NYW-2O3_decoys.pdbqt | data/4N/4NYW-2O3/4NYW-2O3_decoy_scores.csv |
4NQC-2LJ | data/4N/4NQC-2LJ/4NQC-2LJ_ligand.pdbqt | data/4N/4NQC-2LJ/4NQC-2LJ_target.pdbqt | data/4N/4NQC-2LJ/4NQC-2LJ_decoys.pdbqt | data/4N/4NQC-2LJ/4NQC-2LJ_decoy_scores.csv |
4NCW-2KN | data/4N/4NCW-2KN/4NCW-2KN_ligand.pdbqt | data/4N/4NCW-2KN/4NCW-2KN_target.pdbqt | data/4N/4NCW-2KN/4NCW-2KN_decoys.pdbqt | data/4N/4NCW-2KN/4NCW-2KN_decoy_scores.csv |
4N4V-2GY | data/4N/4N4V-2GY/4N4V-2GY_ligand.pdbqt | data/4N/4N4V-2GY/4N4V-2GY_target.pdbqt | data/4N/4N4V-2GY/4N4V-2GY_decoys.pdbqt | data/4N/4N4V-2GY/4N4V-2GY_decoy_scores.csv |
4NG2-OHN | data/4N/4NG2-OHN/4NG2-OHN_ligand.pdbqt | data/4N/4NG2-OHN/4NG2-OHN_target.pdbqt | data/4N/4NG2-OHN/4NG2-OHN_decoys.pdbqt | data/4N/4NG2-OHN/4NG2-OHN_decoy_scores.csv |
4N3E-2AN | data/4N/4N3E-2AN/4N3E-2AN_ligand.pdbqt | data/4N/4N3E-2AN/4N3E-2AN_target.pdbqt | data/4N/4N3E-2AN/4N3E-2AN_decoys.pdbqt | data/4N/4N3E-2AN/4N3E-2AN_decoy_scores.csv |
4N0S-DHC | data/4N/4N0S-DHC/4N0S-DHC_ligand.pdbqt | data/4N/4N0S-DHC/4N0S-DHC_target.pdbqt | data/4N/4N0S-DHC/4N0S-DHC_decoys.pdbqt | data/4N/4N0S-DHC/4N0S-DHC_decoy_scores.csv |
4N1X-PNM | data/4N/4N1X-PNM/4N1X-PNM_ligand.pdbqt | data/4N/4N1X-PNM/4N1X-PNM_target.pdbqt | data/4N/4N1X-PNM/4N1X-PNM_decoys.pdbqt | data/4N/4N1X-PNM/4N1X-PNM_decoy_scores.csv |
4NG6-IPE | data/4N/4NG6-IPE/4NG6-IPE_ligand.pdbqt | data/4N/4NG6-IPE/4NG6-IPE_target.pdbqt | data/4N/4NG6-IPE/4NG6-IPE_decoys.pdbqt | data/4N/4NG6-IPE/4NG6-IPE_decoy_scores.csv |
4NYX-2O4 | data/4N/4NYX-2O4/4NYX-2O4_ligand.pdbqt | data/4N/4NYX-2O4/4NYX-2O4_target.pdbqt | data/4N/4NYX-2O4/4NYX-2O4_decoys.pdbqt | data/4N/4NYX-2O4/4NYX-2O4_decoy_scores.csv |
4NF4-GLU | data/4N/4NF4-GLU/4NF4-GLU_ligand.pdbqt | data/4N/4NF4-GLU/4NF4-GLU_target.pdbqt | data/4N/4NF4-GLU/4NF4-GLU_decoys.pdbqt | data/4N/4NF4-GLU/4NF4-GLU_decoy_scores.csv |
4N6F-F6R | data/4N/4N6F-F6R/4N6F-F6R_ligand.pdbqt | data/4N/4N6F-F6R/4N6F-F6R_target.pdbqt | data/4N/4N6F-F6R/4N6F-F6R_decoys.pdbqt | data/4N/4N6F-F6R/4N6F-F6R_decoy_scores.csv |
4NT2-SPU | data/4N/4NT2-SPU/4NT2-SPU_ligand.pdbqt | data/4N/4NT2-SPU/4NT2-SPU_target.pdbqt | data/4N/4NT2-SPU/4NT2-SPU_decoys.pdbqt | data/4N/4NT2-SPU/4NT2-SPU_decoy_scores.csv |
4NX5-UP6 | data/4N/4NX5-UP6/4NX5-UP6_ligand.pdbqt | data/4N/4NX5-UP6/4NX5-UP6_target.pdbqt | data/4N/4NX5-UP6/4NX5-UP6_decoys.pdbqt | data/4N/4NX5-UP6/4NX5-UP6_decoy_scores.csv |
4ND1-NAD | data/4N/4ND1-NAD/4ND1-NAD_ligand.pdbqt | data/4N/4ND1-NAD/4ND1-NAD_target.pdbqt | data/4N/4ND1-NAD/4ND1-NAD_decoys.pdbqt | data/4N/4ND1-NAD/4ND1-NAD_decoy_scores.csv |
4NQD-2LJ | data/4N/4NQD-2LJ/4NQD-2LJ_ligand.pdbqt | data/4N/4NQD-2LJ/4NQD-2LJ_target.pdbqt | data/4N/4NQD-2LJ/4NQD-2LJ_decoys.pdbqt | data/4N/4NQD-2LJ/4NQD-2LJ_decoy_scores.csv |
4NHO-CXS | data/4N/4NHO-CXS/4NHO-CXS_ligand.pdbqt | data/4N/4NHO-CXS/4NHO-CXS_target.pdbqt | data/4N/4NHO-CXS/4NHO-CXS_decoys.pdbqt | data/4N/4NHO-CXS/4NHO-CXS_decoy_scores.csv |
4NPW-0NY | data/4N/4NPW-0NY/4NPW-0NY_ligand.pdbqt | data/4N/4NPW-0NY/4NPW-0NY_target.pdbqt | data/4N/4NPW-0NY/4NPW-0NY_decoys.pdbqt | data/4N/4NPW-0NY/4NPW-0NY_decoy_scores.csv |
4NUE-NUE | data/4N/4NUE-NUE/4NUE-NUE_ligand.pdbqt | data/4N/4NUE-NUE/4NUE-NUE_target.pdbqt | data/4N/4NUE-NUE/4NUE-NUE_decoys.pdbqt | data/4N/4NUE-NUE/4NUE-NUE_decoy_scores.csv |
4NAL-H70 | data/4N/4NAL-H70/4NAL-H70_ligand.pdbqt | data/4N/4NAL-H70/4NAL-H70_target.pdbqt | data/4N/4NAL-H70/4NAL-H70_decoys.pdbqt | data/4N/4NAL-H70/4NAL-H70_decoy_scores.csv |
4N8R-K08 | data/4N/4N8R-K08/4N8R-K08_ligand.pdbqt | data/4N/4N8R-K08/4N8R-K08_target.pdbqt | data/4N/4N8R-K08/4N8R-K08_decoys.pdbqt | data/4N/4N8R-K08/4N8R-K08_decoy_scores.csv |
4N9W-GDP | data/4N/4N9W-GDP/4N9W-GDP_ligand.pdbqt | data/4N/4N9W-GDP/4N9W-GDP_target.pdbqt | data/4N/4N9W-GDP/4N9W-GDP_decoys.pdbqt | data/4N/4N9W-GDP/4N9W-GDP_decoy_scores.csv |
6WTF-SA8 | data/6W/6WTF-SA8/6WTF-SA8_ligand.pdbqt | data/6W/6WTF-SA8/6WTF-SA8_target.pdbqt | data/6W/6WTF-SA8/6WTF-SA8_decoys.pdbqt | data/6W/6WTF-SA8/6WTF-SA8_decoy_scores.csv |
6W0X-S6J | data/6W/6W0X-S6J/6W0X-S6J_ligand.pdbqt | data/6W/6W0X-S6J/6W0X-S6J_target.pdbqt | data/6W/6W0X-S6J/6W0X-S6J_decoys.pdbqt | data/6W/6W0X-S6J/6W0X-S6J_decoy_scores.csv |
6WN0-U4Y | data/6W/6WN0-U4Y/6WN0-U4Y_ligand.pdbqt | data/6W/6WN0-U4Y/6WN0-U4Y_target.pdbqt | data/6W/6WN0-U4Y/6WN0-U4Y_decoys.pdbqt | data/6W/6WN0-U4Y/6WN0-U4Y_decoy_scores.csv |
6WX3-F9F | data/6W/6WX3-F9F/6WX3-F9F_ligand.pdbqt | data/6W/6WX3-F9F/6WX3-F9F_target.pdbqt | null | null |
6W9I-Z7D | data/6W/6W9I-Z7D/6W9I-Z7D_ligand.pdbqt | data/6W/6W9I-Z7D/6W9I-Z7D_target.pdbqt | data/6W/6W9I-Z7D/6W9I-Z7D_decoys.pdbqt | data/6W/6W9I-Z7D/6W9I-Z7D_decoy_scores.csv |
6WKJ-FDF | data/6W/6WKJ-FDF/6WKJ-FDF_ligand.pdbqt | data/6W/6WKJ-FDF/6WKJ-FDF_target.pdbqt | data/6W/6WKJ-FDF/6WKJ-FDF_decoys.pdbqt | data/6W/6WKJ-FDF/6WKJ-FDF_decoy_scores.csv |
6WTN-RXT | data/6W/6WTN-RXT/6WTN-RXT_ligand.pdbqt | data/6W/6WTN-RXT/6WTN-RXT_target.pdbqt | data/6W/6WTN-RXT/6WTN-RXT_decoys.pdbqt | data/6W/6WTN-RXT/6WTN-RXT_decoy_scores.csv |
6W45-FMN | data/6W/6W45-FMN/6W45-FMN_ligand.pdbqt | data/6W/6W45-FMN/6W45-FMN_target.pdbqt | data/6W/6W45-FMN/6W45-FMN_decoys.pdbqt | data/6W/6W45-FMN/6W45-FMN_decoy_scores.csv |
6W79-X77 | data/6W/6W79-X77/6W79-X77_ligand.pdbqt | data/6W/6W79-X77/6W79-X77_target.pdbqt | data/6W/6W79-X77/6W79-X77_decoys.pdbqt | data/6W/6W79-X77/6W79-X77_decoy_scores.csv |
6WI2-EDT | data/6W/6WI2-EDT/6WI2-EDT_ligand.pdbqt | data/6W/6WI2-EDT/6WI2-EDT_target.pdbqt | data/6W/6WI2-EDT/6WI2-EDT_decoys.pdbqt | data/6W/6WI2-EDT/6WI2-EDT_decoy_scores.csv |
6W57-SZG | data/6W/6W57-SZG/6W57-SZG_ligand.pdbqt | data/6W/6W57-SZG/6W57-SZG_target.pdbqt | data/6W/6W57-SZG/6W57-SZG_decoys.pdbqt | data/6W/6W57-SZG/6W57-SZG_decoy_scores.csv |
6WMV-FLC | data/6W/6WMV-FLC/6WMV-FLC_ligand.pdbqt | data/6W/6WMV-FLC/6WMV-FLC_target.pdbqt | data/6W/6WMV-FLC/6WMV-FLC_decoys.pdbqt | data/6W/6WMV-FLC/6WMV-FLC_decoy_scores.csv |
6WVH-UA7 | data/6W/6WVH-UA7/6WVH-UA7_ligand.pdbqt | data/6W/6WVH-UA7/6WVH-UA7_target.pdbqt | data/6W/6WVH-UA7/6WVH-UA7_decoys.pdbqt | data/6W/6WVH-UA7/6WVH-UA7_decoy_scores.csv |
6WAK-ANP | data/6W/6WAK-ANP/6WAK-ANP_ligand.pdbqt | data/6W/6WAK-ANP/6WAK-ANP_target.pdbqt | data/6W/6WAK-ANP/6WAK-ANP_decoys.pdbqt | data/6W/6WAK-ANP/6WAK-ANP_decoy_scores.csv |
6WOK-U6D | data/6W/6WOK-U6D/6WOK-U6D_ligand.pdbqt | data/6W/6WOK-U6D/6WOK-U6D_target.pdbqt | data/6W/6WOK-U6D/6WOK-U6D_decoys.pdbqt | data/6W/6WOK-U6D/6WOK-U6D_decoy_scores.csv |
6WBZ-TV7 | data/6W/6WBZ-TV7/6WBZ-TV7_ligand.pdbqt | data/6W/6WBZ-TV7/6WBZ-TV7_target.pdbqt | data/6W/6WBZ-TV7/6WBZ-TV7_decoys.pdbqt | data/6W/6WBZ-TV7/6WBZ-TV7_decoy_scores.csv |
6WXN-ANP | data/6W/6WXN-ANP/6WXN-ANP_ligand.pdbqt | data/6W/6WXN-ANP/6WXN-ANP_target.pdbqt | data/6W/6WXN-ANP/6WXN-ANP_decoys.pdbqt | data/6W/6WXN-ANP/6WXN-ANP_decoy_scores.csv |
6WHN-NHE | data/6W/6WHN-NHE/6WHN-NHE_ligand.pdbqt | data/6W/6WHN-NHE/6WHN-NHE_target.pdbqt | data/6W/6WHN-NHE/6WHN-NHE_decoys.pdbqt | data/6W/6WHN-NHE/6WHN-NHE_decoy_scores.csv |
6WDU-KOU | data/6W/6WDU-KOU/6WDU-KOU_ligand.pdbqt | data/6W/6WDU-KOU/6WDU-KOU_target.pdbqt | data/6W/6WDU-KOU/6WDU-KOU_decoys.pdbqt | data/6W/6WDU-KOU/6WDU-KOU_decoy_scores.csv |
6WYY-GLU | data/6W/6WYY-GLU/6WYY-GLU_ligand.pdbqt | data/6W/6WYY-GLU/6WYY-GLU_target.pdbqt | data/6W/6WYY-GLU/6WYY-GLU_decoys.pdbqt | data/6W/6WYY-GLU/6WYY-GLU_decoy_scores.csv |
6WFN-U2J | data/6W/6WFN-U2J/6WFN-U2J_ligand.pdbqt | data/6W/6WFN-U2J/6WFN-U2J_target.pdbqt | data/6W/6WFN-U2J/6WFN-U2J_decoys.pdbqt | data/6W/6WFN-U2J/6WFN-U2J_decoy_scores.csv |
6WK0-RIB | data/6W/6WK0-RIB/6WK0-RIB_ligand.pdbqt | data/6W/6WK0-RIB/6WK0-RIB_target.pdbqt | data/6W/6WK0-RIB/6WK0-RIB_decoys.pdbqt | data/6W/6WK0-RIB/6WK0-RIB_decoy_scores.csv |
6WJZ-A12 | data/6W/6WJZ-A12/6WJZ-A12_ligand.pdbqt | data/6W/6WJZ-A12/6WJZ-A12_target.pdbqt | data/6W/6WJZ-A12/6WJZ-A12_decoys.pdbqt | data/6W/6WJZ-A12/6WJZ-A12_decoy_scores.csv |
6W8M-TJY | data/6W/6W8M-TJY/6W8M-TJY_ligand.pdbqt | data/6W/6W8M-TJY/6W8M-TJY_target.pdbqt | data/6W/6W8M-TJY/6W8M-TJY_decoys.pdbqt | data/6W/6W8M-TJY/6W8M-TJY_decoy_scores.csv |
6W70-GG2 | data/6W/6W70-GG2/6W70-GG2_ligand.pdbqt | data/6W/6W70-GG2/6W70-GG2_target.pdbqt | data/6W/6W70-GG2/6W70-GG2_decoys.pdbqt | data/6W/6W70-GG2/6W70-GG2_decoy_scores.csv |
6W6Z-FMN | data/6W/6W6Z-FMN/6W6Z-FMN_ligand.pdbqt | data/6W/6W6Z-FMN/6W6Z-FMN_target.pdbqt | data/6W/6W6Z-FMN/6W6Z-FMN_decoys.pdbqt | data/6W/6W6Z-FMN/6W6Z-FMN_decoy_scores.csv |
6WC8-TQM | data/6W/6WC8-TQM/6WC8-TQM_ligand.pdbqt | data/6W/6WC8-TQM/6WC8-TQM_target.pdbqt | data/6W/6WC8-TQM/6WC8-TQM_decoys.pdbqt | data/6W/6WC8-TQM/6WC8-TQM_decoy_scores.csv |
6WCO-X47 | data/6W/6WCO-X47/6WCO-X47_ligand.pdbqt | data/6W/6WCO-X47/6WCO-X47_target.pdbqt | data/6W/6WCO-X47/6WCO-X47_decoys.pdbqt | data/6W/6WCO-X47/6WCO-X47_decoy_scores.csv |
6W63-X77 | data/6W/6W63-X77/6W63-X77_ligand.pdbqt | data/6W/6W63-X77/6W63-X77_target.pdbqt | data/6W/6W63-X77/6W63-X77_decoys.pdbqt | data/6W/6W63-X77/6W63-X77_decoy_scores.csv |
6WAB-U61 | data/6W/6WAB-U61/6WAB-U61_ligand.pdbqt | data/6W/6WAB-U61/6WAB-U61_target.pdbqt | data/6W/6WAB-U61/6WAB-U61_decoys.pdbqt | data/6W/6WAB-U61/6WAB-U61_decoy_scores.csv |
6W44-FMN | data/6W/6W44-FMN/6W44-FMN_ligand.pdbqt | data/6W/6W44-FMN/6W44-FMN_target.pdbqt | data/6W/6W44-FMN/6W44-FMN_decoys.pdbqt | data/6W/6W44-FMN/6W44-FMN_decoy_scores.csv |
6WO8-U6J | data/6W/6WO8-U6J/6WO8-U6J_ligand.pdbqt | data/6W/6WO8-U6J/6WO8-U6J_target.pdbqt | data/6W/6WO8-U6J/6WO8-U6J_decoys.pdbqt | data/6W/6WO8-U6J/6WO8-U6J_decoy_scores.csv |
6WNI-FLC | data/6W/6WNI-FLC/6WNI-FLC_ligand.pdbqt | data/6W/6WNI-FLC/6WNI-FLC_target.pdbqt | data/6W/6WNI-FLC/6WNI-FLC_decoys.pdbqt | data/6W/6WNI-FLC/6WNI-FLC_decoy_scores.csv |
6WK1-SAH | data/6W/6WK1-SAH/6WK1-SAH_ligand.pdbqt | data/6W/6WK1-SAH/6WK1-SAH_target.pdbqt | data/6W/6WK1-SAH/6WK1-SAH_decoys.pdbqt | data/6W/6WK1-SAH/6WK1-SAH_decoy_scores.csv |
6WM5-FLC | data/6W/6WM5-FLC/6WM5-FLC_ligand.pdbqt | data/6W/6WM5-FLC/6WM5-FLC_target.pdbqt | data/6W/6WM5-FLC/6WM5-FLC_decoys.pdbqt | data/6W/6WM5-FLC/6WM5-FLC_decoy_scores.csv |
6WE4-FDR | data/6W/6WE4-FDR/6WE4-FDR_ligand.pdbqt | data/6W/6WE4-FDR/6WE4-FDR_target.pdbqt | data/6W/6WE4-FDR/6WE4-FDR_decoys.pdbqt | data/6W/6WE4-FDR/6WE4-FDR_decoy_scores.csv |
6W75-SAM | data/6W/6W75-SAM/6W75-SAM_ligand.pdbqt | data/6W/6W75-SAM/6W75-SAM_target.pdbqt | data/6W/6W75-SAM/6W75-SAM_decoys.pdbqt | data/6W/6W75-SAM/6W75-SAM_decoy_scores.csv |
6WYO-TSN | data/6W/6WYO-TSN/6WYO-TSN_ligand.pdbqt | data/6W/6WYO-TSN/6WYO-TSN_target.pdbqt | data/6W/6WYO-TSN/6WYO-TSN_decoys.pdbqt | data/6W/6WYO-TSN/6WYO-TSN_decoy_scores.csv |
6WJY-U41 | data/6W/6WJY-U41/6WJY-U41_ligand.pdbqt | data/6W/6WJY-U41/6WJY-U41_target.pdbqt | data/6W/6WJY-U41/6WJY-U41_decoys.pdbqt | data/6W/6WJY-U41/6WJY-U41_decoy_scores.csv |
6WQS-U7S | data/6W/6WQS-U7S/6WQS-U7S_ligand.pdbqt | data/6W/6WQS-U7S/6WQS-U7S_target.pdbqt | data/6W/6WQS-U7S/6WQS-U7S_decoys.pdbqt | data/6W/6WQS-U7S/6WQS-U7S_decoy_scores.csv |
6W7L-TGV | data/6W/6W7L-TGV/6W7L-TGV_ligand.pdbqt | data/6W/6W7L-TGV/6W7L-TGV_target.pdbqt | data/6W/6W7L-TGV/6W7L-TGV_decoys.pdbqt | data/6W/6W7L-TGV/6W7L-TGV_decoy_scores.csv |
6WJB-NAD | data/6W/6WJB-NAD/6WJB-NAD_ligand.pdbqt | data/6W/6WJB-NAD/6WJB-NAD_target.pdbqt | data/6W/6WJB-NAD/6WJB-NAD_decoys.pdbqt | data/6W/6WJB-NAD/6WJB-NAD_decoy_scores.csv |
6W9M-TUV | data/6W/6W9M-TUV/6W9M-TUV_ligand.pdbqt | data/6W/6W9M-TUV/6W9M-TUV_target.pdbqt | data/6W/6W9M-TUV/6W9M-TUV_decoys.pdbqt | data/6W/6W9M-TUV/6W9M-TUV_decoy_scores.csv |
6W4C-SL7 | data/6W/6W4C-SL7/6W4C-SL7_ligand.pdbqt | data/6W/6W4C-SL7/6W4C-SL7_target.pdbqt | data/6W/6W4C-SL7/6W4C-SL7_decoys.pdbqt | data/6W/6W4C-SL7/6W4C-SL7_decoy_scores.csv |
6WL5-16A | data/6W/6WL5-16A/6WL5-16A_ligand.pdbqt | data/6W/6WL5-16A/6WL5-16A_target.pdbqt | data/6W/6WL5-16A/6WL5-16A_decoys.pdbqt | data/6W/6WL5-16A/6WL5-16A_decoy_scores.csv |
6WRQ-NIY | data/6W/6WRQ-NIY/6WRQ-NIY_ligand.pdbqt | data/6W/6WRQ-NIY/6WRQ-NIY_target.pdbqt | data/6W/6WRQ-NIY/6WRQ-NIY_decoys.pdbqt | data/6W/6WRQ-NIY/6WRQ-NIY_decoy_scores.csv |
6W4C-FMN | data/6W/6W4C-FMN/6W4C-FMN_ligand.pdbqt | data/6W/6W4C-FMN/6W4C-FMN_target.pdbqt | data/6W/6W4C-FMN/6W4C-FMN_decoys.pdbqt | data/6W/6W4C-FMN/6W4C-FMN_decoy_scores.csv |
6W4G-SL4 | data/6W/6W4G-SL4/6W4G-SL4_ligand.pdbqt | data/6W/6W4G-SL4/6W4G-SL4_target.pdbqt | data/6W/6W4G-SL4/6W4G-SL4_decoys.pdbqt | data/6W/6W4G-SL4/6W4G-SL4_decoy_scores.csv |
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