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 ⌀ |
|---|---|---|---|---|
1M9N-AMZ | data/1M/1M9N-AMZ/1M9N-AMZ_ligand.pdbqt | data/1M/1M9N-AMZ/1M9N-AMZ_target.pdbqt | data/1M/1M9N-AMZ/1M9N-AMZ_decoys.pdbqt | data/1M/1M9N-AMZ/1M9N-AMZ_decoy_scores.csv |
1MGO-NAD | data/1M/1MGO-NAD/1MGO-NAD_ligand.pdbqt | data/1M/1MGO-NAD/1MGO-NAD_target.pdbqt | data/1M/1MGO-NAD/1MGO-NAD_decoys.pdbqt | data/1M/1MGO-NAD/1MGO-NAD_decoy_scores.csv |
1MKY-GDP | data/1M/1MKY-GDP/1MKY-GDP_ligand.pdbqt | data/1M/1MKY-GDP/1MKY-GDP_target.pdbqt | data/1M/1MKY-GDP/1MKY-GDP_decoys.pdbqt | data/1M/1MKY-GDP/1MKY-GDP_decoy_scores.csv |
1MV9-HXA | data/1M/1MV9-HXA/1MV9-HXA_ligand.pdbqt | data/1M/1MV9-HXA/1MV9-HXA_target.pdbqt | data/1M/1MV9-HXA/1MV9-HXA_decoys.pdbqt | data/1M/1MV9-HXA/1MV9-HXA_decoy_scores.csv |
1MAU-ATP | data/1M/1MAU-ATP/1MAU-ATP_ligand.pdbqt | data/1M/1MAU-ATP/1MAU-ATP_target.pdbqt | data/1M/1MAU-ATP/1MAU-ATP_decoys.pdbqt | data/1M/1MAU-ATP/1MAU-ATP_decoy_scores.csv |
1MS8-DAN | data/1M/1MS8-DAN/1MS8-DAN_ligand.pdbqt | data/1M/1MS8-DAN/1MS8-DAN_target.pdbqt | data/1M/1MS8-DAN/1MS8-DAN_decoys.pdbqt | data/1M/1MS8-DAN/1MS8-DAN_decoy_scores.csv |
1MRO-TP7 | data/1M/1MRO-TP7/1MRO-TP7_ligand.pdbqt | data/1M/1MRO-TP7/1MRO-TP7_target.pdbqt | data/1M/1MRO-TP7/1MRO-TP7_decoys.pdbqt | data/1M/1MRO-TP7/1MRO-TP7_decoy_scores.csv |
1ML3-CYX | data/1M/1ML3-CYX/1ML3-CYX_ligand.pdbqt | data/1M/1ML3-CYX/1ML3-CYX_target.pdbqt | data/1M/1ML3-CYX/1ML3-CYX_decoys.pdbqt | data/1M/1ML3-CYX/1ML3-CYX_decoy_scores.csv |
1MOS-AGP | data/1M/1MOS-AGP/1MOS-AGP_ligand.pdbqt | data/1M/1MOS-AGP/1MOS-AGP_target.pdbqt | data/1M/1MOS-AGP/1MOS-AGP_decoys.pdbqt | data/1M/1MOS-AGP/1MOS-AGP_decoy_scores.csv |
1M7Y-PPG | data/1M/1M7Y-PPG/1M7Y-PPG_ligand.pdbqt | data/1M/1M7Y-PPG/1M7Y-PPG_target.pdbqt | data/1M/1M7Y-PPG/1M7Y-PPG_decoys.pdbqt | data/1M/1M7Y-PPG/1M7Y-PPG_decoy_scores.csv |
1M2W-NAD | data/1M/1M2W-NAD/1M2W-NAD_ligand.pdbqt | data/1M/1M2W-NAD/1M2W-NAD_target.pdbqt | data/1M/1M2W-NAD/1M2W-NAD_decoys.pdbqt | data/1M/1M2W-NAD/1M2W-NAD_decoy_scores.csv |
1M6V-ADP | data/1M/1M6V-ADP/1M6V-ADP_ligand.pdbqt | data/1M/1M6V-ADP/1M6V-ADP_target.pdbqt | data/1M/1M6V-ADP/1M6V-ADP_decoys.pdbqt | data/1M/1M6V-ADP/1M6V-ADP_decoy_scores.csv |
1M75-NAD | data/1M/1M75-NAD/1M75-NAD_ligand.pdbqt | data/1M/1M75-NAD/1M75-NAD_target.pdbqt | data/1M/1M75-NAD/1M75-NAD_decoys.pdbqt | data/1M/1M75-NAD/1M75-NAD_decoy_scores.csv |
1MQH-BWD | data/1M/1MQH-BWD/1MQH-BWD_ligand.pdbqt | data/1M/1MQH-BWD/1MQH-BWD_target.pdbqt | data/1M/1MQH-BWD/1MQH-BWD_decoys.pdbqt | data/1M/1MQH-BWD/1MQH-BWD_decoy_scores.csv |
1M5F-AM1 | data/1M/1M5F-AM1/1M5F-AM1_ligand.pdbqt | data/1M/1M5F-AM1/1M5F-AM1_target.pdbqt | data/1M/1M5F-AM1/1M5F-AM1_decoys.pdbqt | data/1M/1M5F-AM1/1M5F-AM1_decoy_scores.csv |
1M7V-ARG | data/1M/1M7V-ARG/1M7V-ARG_ligand.pdbqt | data/1M/1M7V-ARG/1M7V-ARG_target.pdbqt | data/1M/1M7V-ARG/1M7V-ARG_decoys.pdbqt | data/1M/1M7V-ARG/1M7V-ARG_decoy_scores.csv |
1MAR-ZST | data/1M/1MAR-ZST/1MAR-ZST_ligand.pdbqt | data/1M/1MAR-ZST/1MAR-ZST_target.pdbqt | data/1M/1MAR-ZST/1MAR-ZST_decoys.pdbqt | data/1M/1MAR-ZST/1MAR-ZST_decoy_scores.csv |
1M66-BCP | data/1M/1M66-BCP/1M66-BCP_ligand.pdbqt | data/1M/1M66-BCP/1M66-BCP_target.pdbqt | data/1M/1M66-BCP/1M66-BCP_decoys.pdbqt | data/1M/1M66-BCP/1M66-BCP_decoy_scores.csv |
1MBZ-IOT | data/1M/1MBZ-IOT/1MBZ-IOT_ligand.pdbqt | data/1M/1MBZ-IOT/1MBZ-IOT_target.pdbqt | data/1M/1MBZ-IOT/1MBZ-IOT_decoys.pdbqt | data/1M/1MBZ-IOT/1MBZ-IOT_decoy_scores.csv |
1M7A-MQU | data/1M/1M7A-MQU/1M7A-MQU_ligand.pdbqt | data/1M/1M7A-MQU/1M7A-MQU_target.pdbqt | data/1M/1M7A-MQU/1M7A-MQU_decoys.pdbqt | data/1M/1M7A-MQU/1M7A-MQU_decoy_scores.csv |
1MS1-DAN | data/1M/1MS1-DAN/1MS1-DAN_ligand.pdbqt | data/1M/1MS1-DAN/1MS1-DAN_target.pdbqt | data/1M/1MS1-DAN/1MS1-DAN_decoys.pdbqt | data/1M/1MS1-DAN/1MS1-DAN_decoy_scores.csv |
1MDB-DBH | data/1M/1MDB-DBH/1MDB-DBH_ligand.pdbqt | data/1M/1MDB-DBH/1MDB-DBH_target.pdbqt | data/1M/1MDB-DBH/1MDB-DBH_decoys.pdbqt | data/1M/1MDB-DBH/1MDB-DBH_decoy_scores.csv |
1MVC-BM6 | data/1M/1MVC-BM6/1MVC-BM6_ligand.pdbqt | data/1M/1MVC-BM6/1MVC-BM6_target.pdbqt | data/1M/1MVC-BM6/1MVC-BM6_decoys.pdbqt | data/1M/1MVC-BM6/1MVC-BM6_decoy_scores.csv |
1M0N-HCP | data/1M/1M0N-HCP/1M0N-HCP_ligand.pdbqt | data/1M/1M0N-HCP/1M0N-HCP_target.pdbqt | data/1M/1M0N-HCP/1M0N-HCP_decoys.pdbqt | data/1M/1M0N-HCP/1M0N-HCP_decoy_scores.csv |
1MAY-ZAP | data/1M/1MAY-ZAP/1MAY-ZAP_ligand.pdbqt | data/1M/1MAY-ZAP/1MAY-ZAP_target.pdbqt | data/1M/1MAY-ZAP/1MAY-ZAP_decoys.pdbqt | data/1M/1MAY-ZAP/1MAY-ZAP_decoy_scores.csv |
1M4B-NMP | data/1M/1M4B-NMP/1M4B-NMP_ligand.pdbqt | data/1M/1M4B-NMP/1M4B-NMP_target.pdbqt | data/1M/1M4B-NMP/1M4B-NMP_decoys.pdbqt | data/1M/1M4B-NMP/1M4B-NMP_decoy_scores.csv |
1MH1-GNP | data/1M/1MH1-GNP/1MH1-GNP_ligand.pdbqt | data/1M/1MH1-GNP/1MH1-GNP_target.pdbqt | data/1M/1MH1-GNP/1MH1-GNP_decoys.pdbqt | data/1M/1MH1-GNP/1MH1-GNP_decoy_scores.csv |
1MQQ-GCU | data/1M/1MQQ-GCU/1MQQ-GCU_ligand.pdbqt | data/1M/1MQQ-GCU/1MQQ-GCU_target.pdbqt | data/1M/1MQQ-GCU/1MQQ-GCU_decoys.pdbqt | data/1M/1MQQ-GCU/1MQQ-GCU_decoy_scores.csv |
1M4I-KAN | data/1M/1M4I-KAN/1M4I-KAN_ligand.pdbqt | data/1M/1M4I-KAN/1M4I-KAN_target.pdbqt | data/1M/1M4I-KAN/1M4I-KAN_decoys.pdbqt | data/1M/1M4I-KAN/1M4I-KAN_decoy_scores.csv |
1M0W-ANP | data/1M/1M0W-ANP/1M0W-ANP_ligand.pdbqt | data/1M/1M0W-ANP/1M0W-ANP_target.pdbqt | data/1M/1M0W-ANP/1M0W-ANP_decoys.pdbqt | data/1M/1M0W-ANP/1M0W-ANP_decoy_scores.csv |
1M8G-NAD | data/1M/1M8G-NAD/1M8G-NAD_ligand.pdbqt | data/1M/1M8G-NAD/1M8G-NAD_target.pdbqt | data/1M/1M8G-NAD/1M8G-NAD_decoys.pdbqt | data/1M/1M8G-NAD/1M8G-NAD_decoy_scores.csv |
1M5E-AM1 | data/1M/1M5E-AM1/1M5E-AM1_ligand.pdbqt | data/1M/1M5E-AM1/1M5E-AM1_target.pdbqt | data/1M/1M5E-AM1/1M5E-AM1_decoys.pdbqt | data/1M/1M5E-AM1/1M5E-AM1_decoy_scores.csv |
1MRX-K57 | data/1M/1MRX-K57/1MRX-K57_ligand.pdbqt | data/1M/1MRX-K57/1MRX-K57_target.pdbqt | data/1M/1MRX-K57/1MRX-K57_decoys.pdbqt | data/1M/1MRX-K57/1MRX-K57_decoy_scores.csv |
1MK5-BTN | data/1M/1MK5-BTN/1MK5-BTN_ligand.pdbqt | data/1M/1MK5-BTN/1MK5-BTN_target.pdbqt | data/1M/1MK5-BTN/1MK5-BTN_decoys.pdbqt | data/1M/1MK5-BTN/1MK5-BTN_decoy_scores.csv |
1M34-HCA | data/1M/1M34-HCA/1M34-HCA_ligand.pdbqt | data/1M/1M34-HCA/1M34-HCA_target.pdbqt | null | null |
1ML4-PAL | data/1M/1ML4-PAL/1ML4-PAL_ligand.pdbqt | data/1M/1ML4-PAL/1ML4-PAL_target.pdbqt | data/1M/1ML4-PAL/1ML4-PAL_decoys.pdbqt | data/1M/1ML4-PAL/1ML4-PAL_decoy_scores.csv |
1MR2-A12 | data/1M/1MR2-A12/1MR2-A12_ligand.pdbqt | data/1M/1MR2-A12/1MR2-A12_target.pdbqt | data/1M/1MR2-A12/1MR2-A12_decoys.pdbqt | data/1M/1MR2-A12/1MR2-A12_decoy_scores.csv |
1MJL-SAM | data/1M/1MJL-SAM/1MJL-SAM_ligand.pdbqt | data/1M/1MJL-SAM/1MJL-SAM_target.pdbqt | data/1M/1MJL-SAM/1MJL-SAM_decoys.pdbqt | data/1M/1MJL-SAM/1MJL-SAM_decoy_scores.csv |
1MTC-GPR | data/1M/1MTC-GPR/1MTC-GPR_ligand.pdbqt | data/1M/1MTC-GPR/1MTC-GPR_target.pdbqt | data/1M/1MTC-GPR/1MTC-GPR_decoys.pdbqt | data/1M/1MTC-GPR/1MTC-GPR_decoy_scores.csv |
1MG9-SPK | data/1M/1MG9-SPK/1MG9-SPK_ligand.pdbqt | data/1M/1MG9-SPK/1MG9-SPK_target.pdbqt | data/1M/1MG9-SPK/1MG9-SPK_decoys.pdbqt | data/1M/1MG9-SPK/1MG9-SPK_decoy_scores.csv |
1MVL-FMN | data/1M/1MVL-FMN/1MVL-FMN_ligand.pdbqt | data/1M/1MVL-FMN/1MVL-FMN_target.pdbqt | data/1M/1MVL-FMN/1MVL-FMN_decoys.pdbqt | data/1M/1MVL-FMN/1MVL-FMN_decoy_scores.csv |
1M5D-BRH | data/1M/1M5D-BRH/1M5D-BRH_ligand.pdbqt | data/1M/1M5D-BRH/1M5D-BRH_target.pdbqt | data/1M/1M5D-BRH/1M5D-BRH_decoys.pdbqt | data/1M/1M5D-BRH/1M5D-BRH_decoy_scores.csv |
1MMG-AGS | data/1M/1MMG-AGS/1MMG-AGS_ligand.pdbqt | data/1M/1MMG-AGS/1MMG-AGS_target.pdbqt | data/1M/1MMG-AGS/1MMG-AGS_decoys.pdbqt | data/1M/1MMG-AGS/1MMG-AGS_decoy_scores.csv |
1M49-CMM | data/1M/1M49-CMM/1M49-CMM_ligand.pdbqt | data/1M/1M49-CMM/1M49-CMM_target.pdbqt | data/1M/1M49-CMM/1M49-CMM_decoys.pdbqt | data/1M/1M49-CMM/1M49-CMM_decoy_scores.csv |
1MRD-IDP | data/1M/1MRD-IDP/1MRD-IDP_ligand.pdbqt | data/1M/1MRD-IDP/1MRD-IDP_target.pdbqt | data/1M/1MRD-IDP/1MRD-IDP_decoys.pdbqt | data/1M/1MRD-IDP/1MRD-IDP_decoy_scores.csv |
1MEU-DMP | data/1M/1MEU-DMP/1MEU-DMP_ligand.pdbqt | data/1M/1MEU-DMP/1MEU-DMP_target.pdbqt | data/1M/1MEU-DMP/1MEU-DMP_decoys.pdbqt | data/1M/1MEU-DMP/1MEU-DMP_decoy_scores.csv |
1MJH-ATP | data/1M/1MJH-ATP/1MJH-ATP_ligand.pdbqt | data/1M/1MJH-ATP/1MJH-ATP_target.pdbqt | data/1M/1MJH-ATP/1MJH-ATP_decoys.pdbqt | data/1M/1MJH-ATP/1MJH-ATP_decoy_scores.csv |
1M9J-CLW | data/1M/1M9J-CLW/1M9J-CLW_ligand.pdbqt | data/1M/1M9J-CLW/1M9J-CLW_target.pdbqt | data/1M/1M9J-CLW/1M9J-CLW_decoys.pdbqt | data/1M/1M9J-CLW/1M9J-CLW_decoy_scores.csv |
1MXH-DHF | data/1M/1MXH-DHF/1MXH-DHF_ligand.pdbqt | data/1M/1MXH-DHF/1MXH-DHF_target.pdbqt | data/1M/1MXH-DHF/1MXH-DHF_decoys.pdbqt | data/1M/1MXH-DHF/1MXH-DHF_decoy_scores.csv |
1MM6-QUS | data/1M/1MM6-QUS/1MM6-QUS_ligand.pdbqt | data/1M/1MM6-QUS/1MM6-QUS_target.pdbqt | data/1M/1MM6-QUS/1MM6-QUS_decoys.pdbqt | data/1M/1MM6-QUS/1MM6-QUS_decoy_scores.csv |
1MLW-HBI | data/1M/1MLW-HBI/1MLW-HBI_ligand.pdbqt | data/1M/1MLW-HBI/1MLW-HBI_target.pdbqt | data/1M/1MLW-HBI/1MLW-HBI_decoys.pdbqt | data/1M/1MLW-HBI/1MLW-HBI_decoy_scores.csv |
1M8F-NAD | data/1M/1M8F-NAD/1M8F-NAD_ligand.pdbqt | data/1M/1M8F-NAD/1M8F-NAD_target.pdbqt | data/1M/1M8F-NAD/1M8F-NAD_decoys.pdbqt | data/1M/1M8F-NAD/1M8F-NAD_decoy_scores.csv |
1ME7-MOA | data/1M/1ME7-MOA/1ME7-MOA_ligand.pdbqt | data/1M/1ME7-MOA/1ME7-MOA_target.pdbqt | data/1M/1ME7-MOA/1ME7-MOA_decoys.pdbqt | data/1M/1ME7-MOA/1ME7-MOA_decoy_scores.csv |
1MPL-RE1 | data/1M/1MPL-RE1/1MPL-RE1_ligand.pdbqt | data/1M/1MPL-RE1/1MPL-RE1_target.pdbqt | data/1M/1MPL-RE1/1MPL-RE1_decoys.pdbqt | data/1M/1MPL-RE1/1MPL-RE1_decoy_scores.csv |
1MU6-CDA | data/1M/1MU6-CDA/1MU6-CDA_ligand.pdbqt | data/1M/1MU6-CDA/1MU6-CDA_target.pdbqt | data/1M/1MU6-CDA/1MU6-CDA_decoys.pdbqt | data/1M/1MU6-CDA/1MU6-CDA_decoy_scores.csv |
1MEI-XMP | data/1M/1MEI-XMP/1MEI-XMP_ligand.pdbqt | data/1M/1MEI-XMP/1MEI-XMP_target.pdbqt | data/1M/1MEI-XMP/1MEI-XMP_decoys.pdbqt | data/1M/1MEI-XMP/1MEI-XMP_decoy_scores.csv |
1M5B-BN1 | data/1M/1M5B-BN1/1M5B-BN1_ligand.pdbqt | data/1M/1M5B-BN1/1M5B-BN1_target.pdbqt | data/1M/1M5B-BN1/1M5B-BN1_decoys.pdbqt | data/1M/1M5B-BN1/1M5B-BN1_decoy_scores.csv |
1M9M-6NI | data/1M/1M9M-6NI/1M9M-6NI_ligand.pdbqt | data/1M/1M9M-6NI/1M9M-6NI_target.pdbqt | data/1M/1M9M-6NI/1M9M-6NI_decoys.pdbqt | data/1M/1M9M-6NI/1M9M-6NI_decoy_scores.csv |
1M27-FLC | data/1M/1M27-FLC/1M27-FLC_ligand.pdbqt | data/1M/1M27-FLC/1M27-FLC_target.pdbqt | data/1M/1M27-FLC/1M27-FLC_decoys.pdbqt | data/1M/1M27-FLC/1M27-FLC_decoy_scores.csv |
1MQD-SHI | data/1M/1MQD-SHI/1MQD-SHI_ligand.pdbqt | data/1M/1MQD-SHI/1MQD-SHI_target.pdbqt | data/1M/1MQD-SHI/1MQD-SHI_decoys.pdbqt | data/1M/1MQD-SHI/1MQD-SHI_decoy_scores.csv |
1M8D-CLW | data/1M/1M8D-CLW/1M8D-CLW_ligand.pdbqt | data/1M/1M8D-CLW/1M8D-CLW_target.pdbqt | data/1M/1M8D-CLW/1M8D-CLW_decoys.pdbqt | data/1M/1M8D-CLW/1M8D-CLW_decoy_scores.csv |
1MRA-APG | data/1M/1MRA-APG/1MRA-APG_ligand.pdbqt | data/1M/1MRA-APG/1MRA-APG_target.pdbqt | data/1M/1MRA-APG/1MRA-APG_decoys.pdbqt | data/1M/1MRA-APG/1MRA-APG_decoy_scores.csv |
1MVT-DTM | data/1M/1MVT-DTM/1MVT-DTM_ligand.pdbqt | data/1M/1MVT-DTM/1MVT-DTM_target.pdbqt | data/1M/1MVT-DTM/1MVT-DTM_decoys.pdbqt | data/1M/1MVT-DTM/1MVT-DTM_decoy_scores.csv |
1M2H-APR | data/1M/1M2H-APR/1M2H-APR_ligand.pdbqt | data/1M/1M2H-APR/1M2H-APR_target.pdbqt | data/1M/1M2H-APR/1M2H-APR_decoys.pdbqt | data/1M/1M2H-APR/1M2H-APR_decoy_scores.csv |
1MLZ-TZA | data/1M/1MLZ-TZA/1MLZ-TZA_ligand.pdbqt | data/1M/1MLZ-TZA/1MLZ-TZA_target.pdbqt | data/1M/1MLZ-TZA/1MLZ-TZA_decoys.pdbqt | data/1M/1MLZ-TZA/1MLZ-TZA_decoy_scores.csv |
1M9A-GTX | data/1M/1M9A-GTX/1M9A-GTX_ligand.pdbqt | data/1M/1M9A-GTX/1M9A-GTX_target.pdbqt | data/1M/1M9A-GTX/1M9A-GTX_decoys.pdbqt | data/1M/1M9A-GTX/1M9A-GTX_decoy_scores.csv |
1MAX-ZAP | data/1M/1MAX-ZAP/1MAX-ZAP_ligand.pdbqt | data/1M/1MAX-ZAP/1MAX-ZAP_target.pdbqt | data/1M/1MAX-ZAP/1MAX-ZAP_decoys.pdbqt | data/1M/1MAX-ZAP/1MAX-ZAP_decoy_scores.csv |
1MDU-ATP | data/1M/1MDU-ATP/1MDU-ATP_ligand.pdbqt | data/1M/1MDU-ATP/1MDU-ATP_target.pdbqt | data/1M/1MDU-ATP/1MDU-ATP_decoys.pdbqt | data/1M/1MDU-ATP/1MDU-ATP_decoy_scores.csv |
1M67-PLM | data/1M/1M67-PLM/1M67-PLM_ligand.pdbqt | data/1M/1M67-PLM/1M67-PLM_target.pdbqt | data/1M/1M67-PLM/1M67-PLM_decoys.pdbqt | data/1M/1M67-PLM/1M67-PLM_decoy_scores.csv |
1M13-HYF | data/1M/1M13-HYF/1M13-HYF_ligand.pdbqt | data/1M/1M13-HYF/1M13-HYF_target.pdbqt | data/1M/1M13-HYF/1M13-HYF_decoys.pdbqt | data/1M/1M13-HYF/1M13-HYF_decoy_scores.csv |
1MSA-MMA | data/1M/1MSA-MMA/1MSA-MMA_ligand.pdbqt | data/1M/1MSA-MMA/1MSA-MMA_target.pdbqt | data/1M/1MSA-MMA/1MSA-MMA_decoys.pdbqt | data/1M/1MSA-MMA/1MSA-MMA_decoy_scores.csv |
1MEW-XMP | data/1M/1MEW-XMP/1MEW-XMP_ligand.pdbqt | data/1M/1MEW-XMP/1MEW-XMP_target.pdbqt | data/1M/1MEW-XMP/1MEW-XMP_decoys.pdbqt | data/1M/1MEW-XMP/1MEW-XMP_decoy_scores.csv |
1MRK-FMC | data/1M/1MRK-FMC/1MRK-FMC_ligand.pdbqt | data/1M/1MRK-FMC/1MRK-FMC_target.pdbqt | data/1M/1MRK-FMC/1MRK-FMC_decoys.pdbqt | data/1M/1MRK-FMC/1MRK-FMC_decoy_scores.csv |
1M0Q-EPC | data/1M/1M0Q-EPC/1M0Q-EPC_ligand.pdbqt | data/1M/1M0Q-EPC/1M0Q-EPC_target.pdbqt | data/1M/1M0Q-EPC/1M0Q-EPC_decoys.pdbqt | data/1M/1M0Q-EPC/1M0Q-EPC_decoy_scores.csv |
1MSM-JE2 | data/1M/1MSM-JE2/1MSM-JE2_ligand.pdbqt | data/1M/1MSM-JE2/1MSM-JE2_target.pdbqt | data/1M/1MSM-JE2/1MSM-JE2_decoys.pdbqt | data/1M/1MSM-JE2/1MSM-JE2_decoy_scores.csv |
1MAQ-PGU | data/1M/1MAQ-PGU/1MAQ-PGU_ligand.pdbqt | data/1M/1MAQ-PGU/1MAQ-PGU_target.pdbqt | data/1M/1MAQ-PGU/1MAQ-PGU_decoys.pdbqt | data/1M/1MAQ-PGU/1MAQ-PGU_decoy_scores.csv |
1MMX-FUC | data/1M/1MMX-FUC/1MMX-FUC_ligand.pdbqt | data/1M/1MMX-FUC/1MMX-FUC_target.pdbqt | data/1M/1MMX-FUC/1MMX-FUC_decoys.pdbqt | data/1M/1MMX-FUC/1MMX-FUC_decoy_scores.csv |
1M4I-PAP | data/1M/1M4I-PAP/1M4I-PAP_ligand.pdbqt | data/1M/1M4I-PAP/1M4I-PAP_target.pdbqt | data/1M/1M4I-PAP/1M4I-PAP_decoys.pdbqt | data/1M/1M4I-PAP/1M4I-PAP_decoy_scores.csv |
1M7G-ADP | data/1M/1M7G-ADP/1M7G-ADP_ligand.pdbqt | data/1M/1M7G-ADP/1M7G-ADP_target.pdbqt | data/1M/1M7G-ADP/1M7G-ADP_decoys.pdbqt | data/1M/1M7G-ADP/1M7G-ADP_decoy_scores.csv |
1MRE-GDP | data/1M/1MRE-GDP/1MRE-GDP_ligand.pdbqt | data/1M/1MRE-GDP/1MRE-GDP_target.pdbqt | data/1M/1MRE-GDP/1MRE-GDP_decoys.pdbqt | data/1M/1MRE-GDP/1MRE-GDP_decoy_scores.csv |
1M9K-7NI | data/1M/1M9K-7NI/1M9K-7NI_ligand.pdbqt | data/1M/1M9K-7NI/1M9K-7NI_target.pdbqt | data/1M/1M9K-7NI/1M9K-7NI_decoys.pdbqt | data/1M/1M9K-7NI/1M9K-7NI_decoy_scores.csv |
1MXU-BWD | data/1M/1MXU-BWD/1MXU-BWD_ligand.pdbqt | data/1M/1MXU-BWD/1MXU-BWD_target.pdbqt | data/1M/1MXU-BWD/1MXU-BWD_decoys.pdbqt | data/1M/1MXU-BWD/1MXU-BWD_decoy_scores.csv |
1MEX-RAC | data/1M/1MEX-RAC/1MEX-RAC_ligand.pdbqt | data/1M/1MEX-RAC/1MEX-RAC_target.pdbqt | data/1M/1MEX-RAC/1MEX-RAC_decoys.pdbqt | data/1M/1MEX-RAC/1MEX-RAC_decoy_scores.csv |
1MZ9-VDY | data/1M/1MZ9-VDY/1MZ9-VDY_ligand.pdbqt | data/1M/1MZ9-VDY/1MZ9-VDY_target.pdbqt | data/1M/1MZ9-VDY/1MZ9-VDY_decoys.pdbqt | data/1M/1MZ9-VDY/1MZ9-VDY_decoy_scores.csv |
1M0O-MPM | data/1M/1M0O-MPM/1M0O-MPM_ligand.pdbqt | data/1M/1M0O-MPM/1M0O-MPM_target.pdbqt | data/1M/1M0O-MPM/1M0O-MPM_decoys.pdbqt | data/1M/1M0O-MPM/1M0O-MPM_decoy_scores.csv |
1MEZ-GDP | data/1M/1MEZ-GDP/1MEZ-GDP_ligand.pdbqt | data/1M/1MEZ-GDP/1MEZ-GDP_target.pdbqt | data/1M/1MEZ-GDP/1MEZ-GDP_decoys.pdbqt | data/1M/1MEZ-GDP/1MEZ-GDP_decoy_scores.csv |
1MQB-ANP | data/1M/1MQB-ANP/1MQB-ANP_ligand.pdbqt | data/1M/1MQB-ANP/1MQB-ANP_target.pdbqt | data/1M/1MQB-ANP/1MQB-ANP_decoys.pdbqt | data/1M/1MQB-ANP/1MQB-ANP_decoy_scores.csv |
1MOG-RBF | data/1M/1MOG-RBF/1MOG-RBF_ligand.pdbqt | data/1M/1MOG-RBF/1MOG-RBF_target.pdbqt | data/1M/1MOG-RBF/1MOG-RBF_decoys.pdbqt | data/1M/1MOG-RBF/1MOG-RBF_decoy_scores.csv |
1MMA-ADP | data/1M/1MMA-ADP/1MMA-ADP_ligand.pdbqt | data/1M/1MMA-ADP/1MMA-ADP_target.pdbqt | data/1M/1MMA-ADP/1MMA-ADP_decoys.pdbqt | data/1M/1MMA-ADP/1MMA-ADP_decoy_scores.csv |
1M7Z-HAR | data/1M/1M7Z-HAR/1M7Z-HAR_ligand.pdbqt | data/1M/1M7Z-HAR/1M7Z-HAR_target.pdbqt | data/1M/1M7Z-HAR/1M7Z-HAR_decoys.pdbqt | data/1M/1M7Z-HAR/1M7Z-HAR_decoy_scores.csv |
1MP4-UPG | data/1M/1MP4-UPG/1MP4-UPG_ligand.pdbqt | data/1M/1MP4-UPG/1MP4-UPG_target.pdbqt | data/1M/1MP4-UPG/1MP4-UPG_decoys.pdbqt | data/1M/1MP4-UPG/1MP4-UPG_decoy_scores.csv |
1M2O-GNP | data/1M/1M2O-GNP/1M2O-GNP_ligand.pdbqt | data/1M/1M2O-GNP/1M2O-GNP_target.pdbqt | data/1M/1M2O-GNP/1M2O-GNP_decoys.pdbqt | data/1M/1M2O-GNP/1M2O-GNP_decoy_scores.csv |
1MRW-K57 | data/1M/1MRW-K57/1MRW-K57_ligand.pdbqt | data/1M/1MRW-K57/1MRW-K57_target.pdbqt | data/1M/1MRW-K57/1MRW-K57_decoys.pdbqt | data/1M/1MRW-K57/1MRW-K57_decoy_scores.csv |
1MWM-ADP | data/1M/1MWM-ADP/1MWM-ADP_ligand.pdbqt | data/1M/1MWM-ADP/1MWM-ADP_target.pdbqt | data/1M/1MWM-ADP/1MWM-ADP_decoys.pdbqt | data/1M/1MWM-ADP/1MWM-ADP_decoy_scores.csv |
1MQE-APR | data/1M/1MQE-APR/1MQE-APR_ligand.pdbqt | data/1M/1MQE-APR/1MQE-APR_target.pdbqt | null | null |
1MO9-KPC | data/1M/1MO9-KPC/1MO9-KPC_ligand.pdbqt | data/1M/1MO9-KPC/1MO9-KPC_target.pdbqt | data/1M/1MO9-KPC/1MO9-KPC_decoys.pdbqt | data/1M/1MO9-KPC/1MO9-KPC_decoy_scores.csv |
1MBQ-BEN | data/1M/1MBQ-BEN/1MBQ-BEN_ligand.pdbqt | data/1M/1MBQ-BEN/1MBQ-BEN_target.pdbqt | data/1M/1MBQ-BEN/1MBQ-BEN_decoys.pdbqt | data/1M/1MBQ-BEN/1MBQ-BEN_decoy_scores.csv |
1MF0-AMP | data/1M/1MF0-AMP/1MF0-AMP_ligand.pdbqt | data/1M/1MF0-AMP/1MF0-AMP_target.pdbqt | data/1M/1MF0-AMP/1MF0-AMP_decoys.pdbqt | data/1M/1MF0-AMP/1MF0-AMP_decoy_scores.csv |
1MG5-NAI | data/1M/1MG5-NAI/1MG5-NAI_ligand.pdbqt | data/1M/1MG5-NAI/1MG5-NAI_target.pdbqt | data/1M/1MG5-NAI/1MG5-NAI_decoys.pdbqt | data/1M/1MG5-NAI/1MG5-NAI_decoy_scores.csv |
1MMU-BGC | data/1M/1MMU-BGC/1MMU-BGC_ligand.pdbqt | data/1M/1MMU-BGC/1MMU-BGC_target.pdbqt | data/1M/1MMU-BGC/1MMU-BGC_decoys.pdbqt | data/1M/1MMU-BGC/1MMU-BGC_decoy_scores.csv |
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