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 ⌀ |
|---|---|---|---|---|
1ON6-UD1 | data/1O/1ON6-UD1/1ON6-UD1_ligand.pdbqt | data/1O/1ON6-UD1/1ON6-UD1_target.pdbqt | data/1O/1ON6-UD1/1ON6-UD1_decoys.pdbqt | data/1O/1ON6-UD1/1ON6-UD1_decoy_scores.csv |
1O0S-NAI | data/1O/1O0S-NAI/1O0S-NAI_ligand.pdbqt | data/1O/1O0S-NAI/1O0S-NAI_target.pdbqt | data/1O/1O0S-NAI/1O0S-NAI_decoys.pdbqt | data/1O/1O0S-NAI/1O0S-NAI_decoy_scores.csv |
1OIZ-TRT | data/1O/1OIZ-TRT/1OIZ-TRT_ligand.pdbqt | data/1O/1OIZ-TRT/1OIZ-TRT_target.pdbqt | data/1O/1OIZ-TRT/1OIZ-TRT_decoys.pdbqt | data/1O/1OIZ-TRT/1OIZ-TRT_decoy_scores.csv |
1O49-493 | data/1O/1O49-493/1O49-493_ligand.pdbqt | data/1O/1O49-493/1O49-493_target.pdbqt | data/1O/1O49-493/1O49-493_decoys.pdbqt | data/1O/1O49-493/1O49-493_decoy_scores.csv |
1O0M-U2P | data/1O/1O0M-U2P/1O0M-U2P_ligand.pdbqt | data/1O/1O0M-U2P/1O0M-U2P_target.pdbqt | data/1O/1O0M-U2P/1O0M-U2P_decoys.pdbqt | data/1O/1O0M-U2P/1O0M-U2P_decoy_scores.csv |
1O3O-785 | data/1O/1O3O-785/1O3O-785_ligand.pdbqt | data/1O/1O3O-785/1O3O-785_target.pdbqt | data/1O/1O3O-785/1O3O-785_decoys.pdbqt | data/1O/1O3O-785/1O3O-785_decoy_scores.csv |
1OCQ-IFM | data/1O/1OCQ-IFM/1OCQ-IFM_ligand.pdbqt | data/1O/1OCQ-IFM/1OCQ-IFM_target.pdbqt | data/1O/1OCQ-IFM/1OCQ-IFM_decoys.pdbqt | data/1O/1OCQ-IFM/1OCQ-IFM_decoy_scores.csv |
1O6K-ANP | data/1O/1O6K-ANP/1O6K-ANP_ligand.pdbqt | data/1O/1O6K-ANP/1O6K-ANP_target.pdbqt | data/1O/1O6K-ANP/1O6K-ANP_decoys.pdbqt | data/1O/1O6K-ANP/1O6K-ANP_decoy_scores.csv |
1OIY-N41 | data/1O/1OIY-N41/1OIY-N41_ligand.pdbqt | data/1O/1OIY-N41/1OIY-N41_target.pdbqt | data/1O/1OIY-N41/1OIY-N41_decoys.pdbqt | data/1O/1OIY-N41/1OIY-N41_decoy_scores.csv |
1O0A-LI1 | data/1O/1O0A-LI1/1O0A-LI1_ligand.pdbqt | data/1O/1O0A-LI1/1O0A-LI1_target.pdbqt | data/1O/1O0A-LI1/1O0A-LI1_decoys.pdbqt | data/1O/1O0A-LI1/1O0A-LI1_decoy_scores.csv |
1OC2-NAD | data/1O/1OC2-NAD/1OC2-NAD_ligand.pdbqt | data/1O/1OC2-NAD/1OC2-NAD_target.pdbqt | data/1O/1OC2-NAD/1OC2-NAD_decoys.pdbqt | data/1O/1OC2-NAD/1OC2-NAD_decoy_scores.csv |
1OH0-EQU | data/1O/1OH0-EQU/1OH0-EQU_ligand.pdbqt | data/1O/1OH0-EQU/1OH0-EQU_target.pdbqt | data/1O/1OH0-EQU/1OH0-EQU_decoys.pdbqt | data/1O/1OH0-EQU/1OH0-EQU_decoy_scores.csv |
1O0R-GDU | data/1O/1O0R-GDU/1O0R-GDU_ligand.pdbqt | data/1O/1O0R-GDU/1O0R-GDU_target.pdbqt | data/1O/1O0R-GDU/1O0R-GDU_decoys.pdbqt | data/1O/1O0R-GDU/1O0R-GDU_decoy_scores.csv |
1O5M-FPP | data/1O/1O5M-FPP/1O5M-FPP_ligand.pdbqt | data/1O/1O5M-FPP/1O5M-FPP_target.pdbqt | data/1O/1O5M-FPP/1O5M-FPP_decoys.pdbqt | data/1O/1O5M-FPP/1O5M-FPP_decoy_scores.csv |
1OWB-NAD | data/1O/1OWB-NAD/1OWB-NAD_ligand.pdbqt | data/1O/1OWB-NAD/1OWB-NAD_target.pdbqt | data/1O/1OWB-NAD/1OWB-NAD_decoys.pdbqt | data/1O/1OWB-NAD/1OWB-NAD_decoy_scores.csv |
1OBN-ASV | data/1O/1OBN-ASV/1OBN-ASV_ligand.pdbqt | data/1O/1OBN-ASV/1OBN-ASV_target.pdbqt | data/1O/1OBN-ASV/1OBN-ASV_decoys.pdbqt | data/1O/1OBN-ASV/1OBN-ASV_decoy_scores.csv |
1OON-FMN | data/1O/1OON-FMN/1OON-FMN_ligand.pdbqt | data/1O/1OON-FMN/1OON-FMN_target.pdbqt | data/1O/1OON-FMN/1OON-FMN_decoys.pdbqt | data/1O/1OON-FMN/1OON-FMN_decoy_scores.csv |
1OFZ-FUL | data/1O/1OFZ-FUL/1OFZ-FUL_ligand.pdbqt | data/1O/1OFZ-FUL/1OFZ-FUL_target.pdbqt | data/1O/1OFZ-FUL/1OFZ-FUL_decoys.pdbqt | data/1O/1OFZ-FUL/1OFZ-FUL_decoy_scores.csv |
1O6Y-ACP | data/1O/1O6Y-ACP/1O6Y-ACP_ligand.pdbqt | data/1O/1O6Y-ACP/1O6Y-ACP_target.pdbqt | data/1O/1O6Y-ACP/1O6Y-ACP_decoys.pdbqt | data/1O/1O6Y-ACP/1O6Y-ACP_decoy_scores.csv |
1ONH-WY4 | data/1O/1ONH-WY4/1ONH-WY4_ligand.pdbqt | data/1O/1ONH-WY4/1ONH-WY4_target.pdbqt | data/1O/1ONH-WY4/1ONH-WY4_decoys.pdbqt | data/1O/1ONH-WY4/1ONH-WY4_decoy_scores.csv |
1OGX-EQU | data/1O/1OGX-EQU/1OGX-EQU_ligand.pdbqt | data/1O/1OGX-EQU/1OGX-EQU_target.pdbqt | data/1O/1OGX-EQU/1OGX-EQU_decoys.pdbqt | data/1O/1OGX-EQU/1OGX-EQU_decoy_scores.csv |
1OFE-ONL | data/1O/1OFE-ONL/1OFE-ONL_ligand.pdbqt | data/1O/1OFE-ONL/1OFE-ONL_target.pdbqt | data/1O/1OFE-ONL/1OFE-ONL_decoys.pdbqt | data/1O/1OFE-ONL/1OFE-ONL_decoy_scores.csv |
1ODJ-GMP | data/1O/1ODJ-GMP/1ODJ-GMP_ligand.pdbqt | data/1O/1ODJ-GMP/1ODJ-GMP_target.pdbqt | data/1O/1ODJ-GMP/1ODJ-GMP_decoys.pdbqt | data/1O/1ODJ-GMP/1ODJ-GMP_decoy_scores.csv |
1O3G-696 | data/1O/1O3G-696/1O3G-696_ligand.pdbqt | data/1O/1O3G-696/1O3G-696_target.pdbqt | data/1O/1O3G-696/1O3G-696_decoys.pdbqt | data/1O/1O3G-696/1O3G-696_decoy_scores.csv |
1OYB-FMN | data/1O/1OYB-FMN/1OYB-FMN_ligand.pdbqt | data/1O/1OYB-FMN/1OYB-FMN_target.pdbqt | data/1O/1OYB-FMN/1OYB-FMN_decoys.pdbqt | data/1O/1OYB-FMN/1OYB-FMN_decoy_scores.csv |
1ONG-WY4 | data/1O/1ONG-WY4/1ONG-WY4_ligand.pdbqt | data/1O/1ONG-WY4/1ONG-WY4_target.pdbqt | data/1O/1ONG-WY4/1ONG-WY4_decoys.pdbqt | data/1O/1ONG-WY4/1ONG-WY4_decoy_scores.csv |
1OYA-FMN | data/1O/1OYA-FMN/1OYA-FMN_ligand.pdbqt | data/1O/1OYA-FMN/1OYA-FMN_target.pdbqt | data/1O/1OYA-FMN/1OYA-FMN_decoys.pdbqt | data/1O/1OYA-FMN/1OYA-FMN_decoy_scores.csv |
1OQN-I3P | data/1O/1OQN-I3P/1OQN-I3P_ligand.pdbqt | data/1O/1OQN-I3P/1OQN-I3P_target.pdbqt | data/1O/1OQN-I3P/1OQN-I3P_decoys.pdbqt | data/1O/1OQN-I3P/1OQN-I3P_decoy_scores.csv |
1OAB-PEP | data/1O/1OAB-PEP/1OAB-PEP_ligand.pdbqt | data/1O/1OAB-PEP/1OAB-PEP_target.pdbqt | data/1O/1OAB-PEP/1OAB-PEP_decoys.pdbqt | data/1O/1OAB-PEP/1OAB-PEP_decoy_scores.csv |
1O5B-ESI | data/1O/1O5B-ESI/1O5B-ESI_ligand.pdbqt | data/1O/1O5B-ESI/1O5B-ESI_target.pdbqt | data/1O/1O5B-ESI/1O5B-ESI_decoys.pdbqt | data/1O/1O5B-ESI/1O5B-ESI_decoy_scores.csv |
1O2Q-991 | data/1O/1O2Q-991/1O2Q-991_ligand.pdbqt | data/1O/1O2Q-991/1O2Q-991_target.pdbqt | data/1O/1O2Q-991/1O2Q-991_decoys.pdbqt | data/1O/1O2Q-991/1O2Q-991_decoy_scores.csv |
1O2L-762 | data/1O/1O2L-762/1O2L-762_ligand.pdbqt | data/1O/1O2L-762/1O2L-762_target.pdbqt | data/1O/1O2L-762/1O2L-762_decoys.pdbqt | data/1O/1O2L-762/1O2L-762_decoy_scores.csv |
1OT9-HC4 | data/1O/1OT9-HC4/1OT9-HC4_ligand.pdbqt | data/1O/1OT9-HC4/1OT9-HC4_target.pdbqt | data/1O/1OT9-HC4/1OT9-HC4_decoys.pdbqt | data/1O/1OT9-HC4/1OT9-HC4_decoy_scores.csv |
1OPK-P16 | data/1O/1OPK-P16/1OPK-P16_ligand.pdbqt | data/1O/1OPK-P16/1OPK-P16_target.pdbqt | data/1O/1OPK-P16/1OPK-P16_decoys.pdbqt | data/1O/1OPK-P16/1OPK-P16_decoy_scores.csv |
1OFH-ADP | data/1O/1OFH-ADP/1OFH-ADP_ligand.pdbqt | data/1O/1OFH-ADP/1OFH-ADP_target.pdbqt | data/1O/1OFH-ADP/1OFH-ADP_decoys.pdbqt | data/1O/1OFH-ADP/1OFH-ADP_decoy_scores.csv |
1O2V-847 | data/1O/1O2V-847/1O2V-847_ligand.pdbqt | data/1O/1O2V-847/1O2V-847_target.pdbqt | data/1O/1O2V-847/1O2V-847_decoys.pdbqt | data/1O/1O2V-847/1O2V-847_decoy_scores.csv |
1OLT-SAM | data/1O/1OLT-SAM/1OLT-SAM_ligand.pdbqt | data/1O/1OLT-SAM/1OLT-SAM_target.pdbqt | data/1O/1OLT-SAM/1OLT-SAM_decoys.pdbqt | data/1O/1OLT-SAM/1OLT-SAM_decoy_scores.csv |
1OFA-PEP | data/1O/1OFA-PEP/1OFA-PEP_ligand.pdbqt | data/1O/1OFA-PEP/1OFA-PEP_target.pdbqt | data/1O/1OFA-PEP/1OFA-PEP_decoys.pdbqt | data/1O/1OFA-PEP/1OFA-PEP_decoy_scores.csv |
1OIT-HDT | data/1O/1OIT-HDT/1OIT-HDT_ligand.pdbqt | data/1O/1OIT-HDT/1OIT-HDT_target.pdbqt | data/1O/1OIT-HDT/1OIT-HDT_decoys.pdbqt | data/1O/1OIT-HDT/1OIT-HDT_decoy_scores.csv |
1OSH-FEX | data/1O/1OSH-FEX/1OSH-FEX_ligand.pdbqt | data/1O/1OSH-FEX/1OSH-FEX_target.pdbqt | data/1O/1OSH-FEX/1OSH-FEX_decoys.pdbqt | data/1O/1OSH-FEX/1OSH-FEX_decoy_scores.csv |
1OCQ-BGC | data/1O/1OCQ-BGC/1OCQ-BGC_ligand.pdbqt | data/1O/1OCQ-BGC/1OCQ-BGC_target.pdbqt | data/1O/1OCQ-BGC/1OCQ-BGC_decoys.pdbqt | data/1O/1OCQ-BGC/1OCQ-BGC_decoy_scores.csv |
1OFV-FMN | data/1O/1OFV-FMN/1OFV-FMN_ligand.pdbqt | data/1O/1OFV-FMN/1OFV-FMN_target.pdbqt | data/1O/1OFV-FMN/1OFV-FMN_decoys.pdbqt | data/1O/1OFV-FMN/1OFV-FMN_decoy_scores.csv |
1OKM-SAB | data/1O/1OKM-SAB/1OKM-SAB_ligand.pdbqt | data/1O/1OKM-SAB/1OKM-SAB_target.pdbqt | data/1O/1OKM-SAB/1OKM-SAB_decoys.pdbqt | data/1O/1OKM-SAB/1OKM-SAB_decoy_scores.csv |
1OHR-1UN | data/1O/1OHR-1UN/1OHR-1UN_ligand.pdbqt | data/1O/1OHR-1UN/1OHR-1UN_target.pdbqt | data/1O/1OHR-1UN/1OHR-1UN_decoys.pdbqt | data/1O/1OHR-1UN/1OHR-1UN_decoy_scores.csv |
1OTD-HC4 | data/1O/1OTD-HC4/1OTD-HC4_ligand.pdbqt | data/1O/1OTD-HC4/1OTD-HC4_target.pdbqt | data/1O/1OTD-HC4/1OTD-HC4_decoys.pdbqt | data/1O/1OTD-HC4/1OTD-HC4_decoy_scores.csv |
1OSS-BEN | data/1O/1OSS-BEN/1OSS-BEN_ligand.pdbqt | data/1O/1OSS-BEN/1OSS-BEN_target.pdbqt | data/1O/1OSS-BEN/1OSS-BEN_decoys.pdbqt | data/1O/1OSS-BEN/1OSS-BEN_decoy_scores.csv |
1O4P-791 | data/1O/1O4P-791/1O4P-791_ligand.pdbqt | data/1O/1O4P-791/1O4P-791_target.pdbqt | data/1O/1O4P-791/1O4P-791_decoys.pdbqt | data/1O/1O4P-791/1O4P-791_decoy_scores.csv |
1OTE-HC4 | data/1O/1OTE-HC4/1OTE-HC4_ligand.pdbqt | data/1O/1OTE-HC4/1OTE-HC4_target.pdbqt | data/1O/1OTE-HC4/1OTE-HC4_decoys.pdbqt | data/1O/1OTE-HC4/1OTE-HC4_decoy_scores.csv |
1O4I-219 | data/1O/1O4I-219/1O4I-219_ligand.pdbqt | data/1O/1O4I-219/1O4I-219_target.pdbqt | data/1O/1O4I-219/1O4I-219_decoys.pdbqt | data/1O/1O4I-219/1O4I-219_decoy_scores.csv |
1O9B-NAI | data/1O/1O9B-NAI/1O9B-NAI_ligand.pdbqt | data/1O/1O9B-NAI/1O9B-NAI_target.pdbqt | data/1O/1O9B-NAI/1O9B-NAI_decoys.pdbqt | data/1O/1O9B-NAI/1O9B-NAI_decoy_scores.csv |
1O3Y-GTP | data/1O/1O3Y-GTP/1O3Y-GTP_ligand.pdbqt | data/1O/1O3Y-GTP/1O3Y-GTP_target.pdbqt | data/1O/1O3Y-GTP/1O3Y-GTP_decoys.pdbqt | data/1O/1O3Y-GTP/1O3Y-GTP_decoy_scores.csv |
1OKN-STB | data/1O/1OKN-STB/1OKN-STB_ligand.pdbqt | data/1O/1OKN-STB/1OKN-STB_target.pdbqt | data/1O/1OKN-STB/1OKN-STB_decoys.pdbqt | data/1O/1OKN-STB/1OKN-STB_decoy_scores.csv |
1O7S-NDG | data/1O/1O7S-NDG/1O7S-NDG_ligand.pdbqt | data/1O/1O7S-NDG/1O7S-NDG_target.pdbqt | data/1O/1O7S-NDG/1O7S-NDG_decoys.pdbqt | data/1O/1O7S-NDG/1O7S-NDG_decoy_scores.csv |
1O2K-656 | data/1O/1O2K-656/1O2K-656_ligand.pdbqt | data/1O/1O2K-656/1O2K-656_target.pdbqt | data/1O/1O2K-656/1O2K-656_decoys.pdbqt | data/1O/1O2K-656/1O2K-656_decoy_scores.csv |
1OQ5-CEL | data/1O/1OQ5-CEL/1OQ5-CEL_ligand.pdbqt | data/1O/1OQ5-CEL/1OQ5-CEL_target.pdbqt | data/1O/1OQ5-CEL/1OQ5-CEL_decoys.pdbqt | data/1O/1OQ5-CEL/1OQ5-CEL_decoy_scores.csv |
1O3B-780 | data/1O/1O3B-780/1O3B-780_ligand.pdbqt | data/1O/1O3B-780/1O3B-780_target.pdbqt | data/1O/1O3B-780/1O3B-780_decoys.pdbqt | data/1O/1O3B-780/1O3B-780_decoy_scores.csv |
1O43-821 | data/1O/1O43-821/1O43-821_ligand.pdbqt | data/1O/1O43-821/1O43-821_target.pdbqt | data/1O/1O43-821/1O43-821_decoys.pdbqt | data/1O/1O43-821/1O43-821_decoy_scores.csv |
1O44-852 | data/1O/1O44-852/1O44-852_ligand.pdbqt | data/1O/1O44-852/1O44-852_target.pdbqt | data/1O/1O44-852/1O44-852_decoys.pdbqt | data/1O/1O44-852/1O44-852_decoy_scores.csv |
1O2O-950 | data/1O/1O2O-950/1O2O-950_ligand.pdbqt | data/1O/1O2O-950/1O2O-950_target.pdbqt | data/1O/1O2O-950/1O2O-950_decoys.pdbqt | data/1O/1O2O-950/1O2O-950_decoy_scores.csv |
1O76-CAM | data/1O/1O76-CAM/1O76-CAM_ligand.pdbqt | data/1O/1O76-CAM/1O76-CAM_target.pdbqt | data/1O/1O76-CAM/1O76-CAM_decoys.pdbqt | data/1O/1O76-CAM/1O76-CAM_decoy_scores.csv |
1OI9-N20 | data/1O/1OI9-N20/1OI9-N20_ligand.pdbqt | data/1O/1OI9-N20/1OI9-N20_target.pdbqt | data/1O/1OI9-N20/1OI9-N20_decoys.pdbqt | data/1O/1OI9-N20/1OI9-N20_decoy_scores.csv |
1O5R-FR9 | data/1O/1O5R-FR9/1O5R-FR9_ligand.pdbqt | data/1O/1O5R-FR9/1O5R-FR9_target.pdbqt | data/1O/1O5R-FR9/1O5R-FR9_decoys.pdbqt | data/1O/1O5R-FR9/1O5R-FR9_decoy_scores.csv |
1O98-2PG | data/1O/1O98-2PG/1O98-2PG_ligand.pdbqt | data/1O/1O98-2PG/1O98-2PG_target.pdbqt | data/1O/1O98-2PG/1O98-2PG_decoys.pdbqt | data/1O/1O98-2PG/1O98-2PG_decoy_scores.csv |
1OCN-IFM | data/1O/1OCN-IFM/1OCN-IFM_ligand.pdbqt | data/1O/1OCN-IFM/1OCN-IFM_target.pdbqt | data/1O/1OCN-IFM/1OCN-IFM_decoys.pdbqt | data/1O/1OCN-IFM/1OCN-IFM_decoy_scores.csv |
1OOQ-DTC | data/1O/1OOQ-DTC/1OOQ-DTC_ligand.pdbqt | data/1O/1OOQ-DTC/1OOQ-DTC_target.pdbqt | data/1O/1OOQ-DTC/1OOQ-DTC_decoys.pdbqt | data/1O/1OOQ-DTC/1OOQ-DTC_decoy_scores.csv |
1OIM-NOJ | data/1O/1OIM-NOJ/1OIM-NOJ_ligand.pdbqt | data/1O/1OIM-NOJ/1OIM-NOJ_target.pdbqt | data/1O/1OIM-NOJ/1OIM-NOJ_decoys.pdbqt | data/1O/1OIM-NOJ/1OIM-NOJ_decoy_scores.csv |
1OM4-ARG | data/1O/1OM4-ARG/1OM4-ARG_ligand.pdbqt | data/1O/1OM4-ARG/1OM4-ARG_target.pdbqt | data/1O/1OM4-ARG/1OM4-ARG_decoys.pdbqt | data/1O/1OM4-ARG/1OM4-ARG_decoy_scores.csv |
1O3D-780 | data/1O/1O3D-780/1O3D-780_ligand.pdbqt | data/1O/1O3D-780/1O3D-780_target.pdbqt | data/1O/1O3D-780/1O3D-780_decoys.pdbqt | data/1O/1O3D-780/1O3D-780_decoy_scores.csv |
1O48-853 | data/1O/1O48-853/1O48-853_ligand.pdbqt | data/1O/1O48-853/1O48-853_target.pdbqt | data/1O/1O48-853/1O48-853_decoys.pdbqt | data/1O/1O48-853/1O48-853_decoy_scores.csv |
1OD9-BND | data/1O/1OD9-BND/1OD9-BND_ligand.pdbqt | data/1O/1OD9-BND/1OD9-BND_target.pdbqt | data/1O/1OD9-BND/1OD9-BND_decoys.pdbqt | data/1O/1OD9-BND/1OD9-BND_decoy_scores.csv |
1O2H-CR3 | data/1O/1O2H-CR3/1O2H-CR3_ligand.pdbqt | data/1O/1O2H-CR3/1O2H-CR3_target.pdbqt | data/1O/1O2H-CR3/1O2H-CR3_decoys.pdbqt | data/1O/1O2H-CR3/1O2H-CR3_decoy_scores.csv |
1OXQ-P33 | data/1O/1OXQ-P33/1OXQ-P33_ligand.pdbqt | data/1O/1OXQ-P33/1OXQ-P33_target.pdbqt | data/1O/1OXQ-P33/1OXQ-P33_decoys.pdbqt | data/1O/1OXQ-P33/1OXQ-P33_decoy_scores.csv |
1OPB-RET | data/1O/1OPB-RET/1OPB-RET_ligand.pdbqt | data/1O/1OPB-RET/1OPB-RET_target.pdbqt | data/1O/1OPB-RET/1OPB-RET_decoys.pdbqt | data/1O/1OPB-RET/1OPB-RET_decoy_scores.csv |
1O3E-696 | data/1O/1O3E-696/1O3E-696_ligand.pdbqt | data/1O/1O3E-696/1O3E-696_target.pdbqt | data/1O/1O3E-696/1O3E-696_decoys.pdbqt | data/1O/1O3E-696/1O3E-696_decoy_scores.csv |
1OZQ-PRF | data/1O/1OZQ-PRF/1OZQ-PRF_ligand.pdbqt | data/1O/1OZQ-PRF/1OZQ-PRF_target.pdbqt | data/1O/1OZQ-PRF/1OZQ-PRF_decoys.pdbqt | data/1O/1OZQ-PRF/1OZQ-PRF_decoy_scores.csv |
1OL5-ADP | data/1O/1OL5-ADP/1OL5-ADP_ligand.pdbqt | data/1O/1OL5-ADP/1OL5-ADP_target.pdbqt | data/1O/1OL5-ADP/1OL5-ADP_decoys.pdbqt | data/1O/1OL5-ADP/1OL5-ADP_decoy_scores.csv |
1O4R-787 | data/1O/1O4R-787/1O4R-787_ligand.pdbqt | data/1O/1O4R-787/1O4R-787_target.pdbqt | data/1O/1O4R-787/1O4R-787_decoys.pdbqt | data/1O/1O4R-787/1O4R-787_decoy_scores.csv |
1OX5-1PR | data/1O/1OX5-1PR/1OX5-1PR_ligand.pdbqt | data/1O/1OX5-1PR/1OX5-1PR_target.pdbqt | data/1O/1OX5-1PR/1OX5-1PR_decoys.pdbqt | data/1O/1OX5-1PR/1OX5-1PR_decoy_scores.csv |
1O0H-ADP | data/1O/1O0H-ADP/1O0H-ADP_ligand.pdbqt | data/1O/1O0H-ADP/1O0H-ADP_target.pdbqt | data/1O/1O0H-ADP/1O0H-ADP_decoys.pdbqt | data/1O/1O0H-ADP/1O0H-ADP_decoy_scores.csv |
1O25-UMP | data/1O/1O25-UMP/1O25-UMP_ligand.pdbqt | data/1O/1O25-UMP/1O25-UMP_target.pdbqt | data/1O/1O25-UMP/1O25-UMP_decoys.pdbqt | data/1O/1O25-UMP/1O25-UMP_decoy_scores.csv |
1OXN-P33 | data/1O/1OXN-P33/1OXN-P33_ligand.pdbqt | data/1O/1OXN-P33/1OXN-P33_target.pdbqt | data/1O/1OXN-P33/1OXN-P33_decoys.pdbqt | data/1O/1OXN-P33/1OXN-P33_decoy_scores.csv |
1OC1-ASV | data/1O/1OC1-ASV/1OC1-ASV_ligand.pdbqt | data/1O/1OC1-ASV/1OC1-ASV_target.pdbqt | data/1O/1OC1-ASV/1OC1-ASV_decoys.pdbqt | data/1O/1OC1-ASV/1OC1-ASV_decoy_scores.csv |
1OI6-TMP | data/1O/1OI6-TMP/1OI6-TMP_ligand.pdbqt | data/1O/1OI6-TMP/1OI6-TMP_target.pdbqt | data/1O/1OI6-TMP/1OI6-TMP_decoys.pdbqt | data/1O/1OI6-TMP/1OI6-TMP_decoy_scores.csv |
1O4A-197 | data/1O/1O4A-197/1O4A-197_ligand.pdbqt | data/1O/1O4A-197/1O4A-197_target.pdbqt | data/1O/1O4A-197/1O4A-197_decoys.pdbqt | data/1O/1O4A-197/1O4A-197_decoy_scores.csv |
1OF6-DTY | data/1O/1OF6-DTY/1OF6-DTY_ligand.pdbqt | data/1O/1OF6-DTY/1OF6-DTY_target.pdbqt | data/1O/1OF6-DTY/1OF6-DTY_decoys.pdbqt | data/1O/1OF6-DTY/1OF6-DTY_decoy_scores.csv |
1O36-607 | data/1O/1O36-607/1O36-607_ligand.pdbqt | data/1O/1O36-607/1O36-607_target.pdbqt | data/1O/1O36-607/1O36-607_decoys.pdbqt | data/1O/1O36-607/1O36-607_decoy_scores.csv |
1OJ9-1PB | data/1O/1OJ9-1PB/1OJ9-1PB_ligand.pdbqt | data/1O/1OJ9-1PB/1OJ9-1PB_target.pdbqt | data/1O/1OJ9-1PB/1OJ9-1PB_decoys.pdbqt | data/1O/1OJ9-1PB/1OJ9-1PB_decoy_scores.csv |
1OHK-COP | data/1O/1OHK-COP/1OHK-COP_ligand.pdbqt | data/1O/1OHK-COP/1OHK-COP_target.pdbqt | data/1O/1OHK-COP/1OHK-COP_decoys.pdbqt | data/1O/1OHK-COP/1OHK-COP_decoy_scores.csv |
1O2M-762 | data/1O/1O2M-762/1O2M-762_ligand.pdbqt | data/1O/1O2M-762/1O2M-762_target.pdbqt | data/1O/1O2M-762/1O2M-762_decoys.pdbqt | data/1O/1O2M-762/1O2M-762_decoy_scores.csv |
1O3N-785 | data/1O/1O3N-785/1O3N-785_ligand.pdbqt | data/1O/1O3N-785/1O3N-785_target.pdbqt | data/1O/1O3N-785/1O3N-785_decoys.pdbqt | data/1O/1O3N-785/1O3N-785_decoy_scores.csv |
1OIX-GDP | data/1O/1OIX-GDP/1OIX-GDP_ligand.pdbqt | data/1O/1OIX-GDP/1OIX-GDP_target.pdbqt | data/1O/1OIX-GDP/1OIX-GDP_decoys.pdbqt | data/1O/1OIX-GDP/1OIX-GDP_decoy_scores.csv |
1OYO-3ID | data/1O/1OYO-3ID/1OYO-3ID_ligand.pdbqt | data/1O/1OYO-3ID/1OYO-3ID_target.pdbqt | data/1O/1OYO-3ID/1OYO-3ID_decoys.pdbqt | data/1O/1OYO-3ID/1OYO-3ID_decoy_scores.csv |
1OIN-G2F | data/1O/1OIN-G2F/1OIN-G2F_ligand.pdbqt | data/1O/1OIN-G2F/1OIN-G2F_target.pdbqt | data/1O/1OIN-G2F/1OIN-G2F_decoys.pdbqt | data/1O/1OIN-G2F/1OIN-G2F_decoy_scores.csv |
1OS6-DXC | data/1O/1OS6-DXC/1OS6-DXC_ligand.pdbqt | data/1O/1OS6-DXC/1OS6-DXC_target.pdbqt | data/1O/1OS6-DXC/1OS6-DXC_decoys.pdbqt | data/1O/1OS6-DXC/1OS6-DXC_decoy_scores.csv |
1O0A-SQU | data/1O/1O0A-SQU/1O0A-SQU_ligand.pdbqt | data/1O/1O0A-SQU/1O0A-SQU_target.pdbqt | data/1O/1O0A-SQU/1O0A-SQU_decoys.pdbqt | data/1O/1O0A-SQU/1O0A-SQU_decoy_scores.csv |
1O4E-299 | data/1O/1O4E-299/1O4E-299_ligand.pdbqt | data/1O/1O4E-299/1O4E-299_target.pdbqt | data/1O/1O4E-299/1O4E-299_decoys.pdbqt | data/1O/1O4E-299/1O4E-299_decoy_scores.csv |
1OHJ-COP | data/1O/1OHJ-COP/1OHJ-COP_ligand.pdbqt | data/1O/1OHJ-COP/1OHJ-COP_target.pdbqt | data/1O/1OHJ-COP/1OHJ-COP_decoys.pdbqt | data/1O/1OHJ-COP/1OHJ-COP_decoy_scores.csv |
1O3J-334 | data/1O/1O3J-334/1O3J-334_ligand.pdbqt | data/1O/1O3J-334/1O3J-334_target.pdbqt | data/1O/1O3J-334/1O3J-334_decoys.pdbqt | data/1O/1O3J-334/1O3J-334_decoy_scores.csv |
1ORF-0G6 | data/1O/1ORF-0G6/1ORF-0G6_ligand.pdbqt | data/1O/1ORF-0G6/1ORF-0G6_target.pdbqt | data/1O/1ORF-0G6/1ORF-0G6_decoys.pdbqt | data/1O/1ORF-0G6/1ORF-0G6_decoy_scores.csv |
1OBH-LMS | data/1O/1OBH-LMS/1OBH-LMS_ligand.pdbqt | data/1O/1OBH-LMS/1OBH-LMS_target.pdbqt | data/1O/1OBH-LMS/1OBH-LMS_decoys.pdbqt | data/1O/1OBH-LMS/1OBH-LMS_decoy_scores.csv |
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