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 ⌀ |
|---|---|---|---|---|
5WYF-ILP | data/5W/5WYF-ILP/5WYF-ILP_ligand.pdbqt | data/5W/5WYF-ILP/5WYF-ILP_target.pdbqt | data/5W/5WYF-ILP/5WYF-ILP_decoys.pdbqt | data/5W/5WYF-ILP/5WYF-ILP_decoy_scores.csv |
5WIF-PG5 | data/5W/5WIF-PG5/5WIF-PG5_ligand.pdbqt | data/5W/5WIF-PG5/5WIF-PG5_target.pdbqt | data/5W/5WIF-PG5/5WIF-PG5_decoys.pdbqt | data/5W/5WIF-PG5/5WIF-PG5_decoy_scores.csv |
5WEB-KU5 | data/5W/5WEB-KU5/5WEB-KU5_ligand.pdbqt | data/5W/5WEB-KU5/5WEB-KU5_target.pdbqt | data/5W/5WEB-KU5/5WEB-KU5_decoys.pdbqt | data/5W/5WEB-KU5/5WEB-KU5_decoy_scores.csv |
5WE8-A7Y | data/5W/5WE8-A7Y/5WE8-A7Y_ligand.pdbqt | data/5W/5WE8-A7Y/5WE8-A7Y_target.pdbqt | data/5W/5WE8-A7Y/5WE8-A7Y_decoys.pdbqt | data/5W/5WE8-A7Y/5WE8-A7Y_decoy_scores.csv |
5W8G-SAH | data/5W/5W8G-SAH/5W8G-SAH_ligand.pdbqt | data/5W/5W8G-SAH/5W8G-SAH_target.pdbqt | data/5W/5W8G-SAH/5W8G-SAH_decoys.pdbqt | data/5W/5W8G-SAH/5W8G-SAH_decoy_scores.csv |
5WQX-T65 | data/5W/5WQX-T65/5WQX-T65_ligand.pdbqt | data/5W/5WQX-T65/5WQX-T65_target.pdbqt | data/5W/5WQX-T65/5WQX-T65_decoys.pdbqt | data/5W/5WQX-T65/5WQX-T65_decoy_scores.csv |
5WIJ-AQG | data/5W/5WIJ-AQG/5WIJ-AQG_ligand.pdbqt | data/5W/5WIJ-AQG/5WIJ-AQG_target.pdbqt | data/5W/5WIJ-AQG/5WIJ-AQG_decoys.pdbqt | data/5W/5WIJ-AQG/5WIJ-AQG_decoy_scores.csv |
5WM5-B5Y | data/5W/5WM5-B5Y/5WM5-B5Y_ligand.pdbqt | data/5W/5WM5-B5Y/5WM5-B5Y_target.pdbqt | data/5W/5WM5-B5Y/5WM5-B5Y_decoys.pdbqt | data/5W/5WM5-B5Y/5WM5-B5Y_decoy_scores.csv |
5WP4-SAH | data/5W/5WP4-SAH/5WP4-SAH_ligand.pdbqt | data/5W/5WP4-SAH/5WP4-SAH_target.pdbqt | data/5W/5WP4-SAH/5WP4-SAH_decoys.pdbqt | data/5W/5WP4-SAH/5WP4-SAH_decoy_scores.csv |
5WQ2-AG7 | data/5W/5WQ2-AG7/5WQ2-AG7_ligand.pdbqt | data/5W/5WQ2-AG7/5WQ2-AG7_target.pdbqt | data/5W/5WQ2-AG7/5WQ2-AG7_decoys.pdbqt | data/5W/5WQ2-AG7/5WQ2-AG7_decoy_scores.csv |
5WZS-7W9 | data/5W/5WZS-7W9/5WZS-7W9_ligand.pdbqt | data/5W/5WZS-7W9/5WZS-7W9_target.pdbqt | data/5W/5WZS-7W9/5WZS-7W9_decoys.pdbqt | data/5W/5WZS-7W9/5WZS-7W9_decoy_scores.csv |
5WI7-4J6 | data/5W/5WI7-4J6/5WI7-4J6_ligand.pdbqt | data/5W/5WI7-4J6/5WI7-4J6_target.pdbqt | data/5W/5WI7-4J6/5WI7-4J6_decoys.pdbqt | data/5W/5WI7-4J6/5WI7-4J6_decoy_scores.csv |
5W10-CMP | data/5W/5W10-CMP/5W10-CMP_ligand.pdbqt | data/5W/5W10-CMP/5W10-CMP_target.pdbqt | data/5W/5W10-CMP/5W10-CMP_decoys.pdbqt | data/5W/5W10-CMP/5W10-CMP_decoy_scores.csv |
5W6Y-TRP | data/5W/5W6Y-TRP/5W6Y-TRP_ligand.pdbqt | data/5W/5W6Y-TRP/5W6Y-TRP_target.pdbqt | data/5W/5W6Y-TRP/5W6Y-TRP_decoys.pdbqt | data/5W/5W6Y-TRP/5W6Y-TRP_decoy_scores.csv |
5WBM-A4G | data/5W/5WBM-A4G/5WBM-A4G_ligand.pdbqt | data/5W/5WBM-A4G/5WBM-A4G_target.pdbqt | data/5W/5WBM-A4G/5WBM-A4G_decoys.pdbqt | data/5W/5WBM-A4G/5WBM-A4G_decoy_scores.csv |
5WCM-4NZ | data/5W/5WCM-4NZ/5WCM-4NZ_ligand.pdbqt | data/5W/5WCM-4NZ/5WCM-4NZ_target.pdbqt | data/5W/5WCM-4NZ/5WCM-4NZ_decoys.pdbqt | data/5W/5WCM-4NZ/5WCM-4NZ_decoy_scores.csv |
5WHR-AOJ | data/5W/5WHR-AOJ/5WHR-AOJ_ligand.pdbqt | data/5W/5WHR-AOJ/5WHR-AOJ_target.pdbqt | data/5W/5WHR-AOJ/5WHR-AOJ_decoys.pdbqt | data/5W/5WHR-AOJ/5WHR-AOJ_decoy_scores.csv |
5W7E-FAW | data/5W/5W7E-FAW/5W7E-FAW_ligand.pdbqt | data/5W/5W7E-FAW/5W7E-FAW_target.pdbqt | data/5W/5W7E-FAW/5W7E-FAW_decoys.pdbqt | data/5W/5W7E-FAW/5W7E-FAW_decoy_scores.csv |
5WS3-OLA | data/5W/5WS3-OLA/5WS3-OLA_ligand.pdbqt | data/5W/5WS3-OLA/5WS3-OLA_target.pdbqt | data/5W/5WS3-OLA/5WS3-OLA_decoys.pdbqt | data/5W/5WS3-OLA/5WS3-OLA_decoy_scores.csv |
5WA7-KU4 | data/5W/5WA7-KU4/5WA7-KU4_ligand.pdbqt | data/5W/5WA7-KU4/5WA7-KU4_target.pdbqt | data/5W/5WA7-KU4/5WA7-KU4_decoys.pdbqt | data/5W/5WA7-KU4/5WA7-KU4_decoy_scores.csv |
5W49-NAD | data/5W/5W49-NAD/5W49-NAD_ligand.pdbqt | data/5W/5W49-NAD/5W49-NAD_target.pdbqt | data/5W/5W49-NAD/5W49-NAD_decoys.pdbqt | data/5W/5W49-NAD/5W49-NAD_decoy_scores.csv |
5WKC-AUJ | data/5W/5WKC-AUJ/5WKC-AUJ_ligand.pdbqt | data/5W/5WKC-AUJ/5WKC-AUJ_target.pdbqt | data/5W/5WKC-AUJ/5WKC-AUJ_decoys.pdbqt | data/5W/5WKC-AUJ/5WKC-AUJ_decoy_scores.csv |
5W7T-ANP | data/5W/5W7T-ANP/5W7T-ANP_ligand.pdbqt | data/5W/5W7T-ANP/5W7T-ANP_target.pdbqt | data/5W/5W7T-ANP/5W7T-ANP_decoys.pdbqt | data/5W/5W7T-ANP/5W7T-ANP_decoy_scores.csv |
5WS1-7U9 | data/5W/5WS1-7U9/5WS1-7U9_ligand.pdbqt | data/5W/5WS1-7U9/5WS1-7U9_target.pdbqt | data/5W/5WS1-7U9/5WS1-7U9_decoys.pdbqt | data/5W/5WS1-7U9/5WS1-7U9_decoy_scores.csv |
5WS7-6U4 | data/5W/5WS7-6U4/5WS7-6U4_ligand.pdbqt | data/5W/5WS7-6U4/5WS7-6U4_target.pdbqt | data/5W/5WS7-6U4/5WS7-6U4_decoys.pdbqt | data/5W/5WS7-6U4/5WS7-6U4_decoy_scores.csv |
5WU0-NAI | data/5W/5WU0-NAI/5WU0-NAI_ligand.pdbqt | data/5W/5WU0-NAI/5WU0-NAI_target.pdbqt | data/5W/5WU0-NAI/5WU0-NAI_decoys.pdbqt | data/5W/5WU0-NAI/5WU0-NAI_decoy_scores.csv |
5WM2-SAL | data/5W/5WM2-SAL/5WM2-SAL_ligand.pdbqt | data/5W/5WM2-SAL/5WM2-SAL_target.pdbqt | data/5W/5WM2-SAL/5WM2-SAL_decoys.pdbqt | data/5W/5WM2-SAL/5WM2-SAL_decoy_scores.csv |
5WIV-OLA | data/5W/5WIV-OLA/5WIV-OLA_ligand.pdbqt | data/5W/5WIV-OLA/5WIV-OLA_target.pdbqt | data/5W/5WIV-OLA/5WIV-OLA_decoys.pdbqt | data/5W/5WIV-OLA/5WIV-OLA_decoy_scores.csv |
5WK7-CAH | data/5W/5WK7-CAH/5WK7-CAH_ligand.pdbqt | data/5W/5WK7-CAH/5WK7-CAH_target.pdbqt | data/5W/5WK7-CAH/5WK7-CAH_decoys.pdbqt | data/5W/5WK7-CAH/5WK7-CAH_decoy_scores.csv |
5W8C-MTA | data/5W/5W8C-MTA/5W8C-MTA_ligand.pdbqt | data/5W/5W8C-MTA/5W8C-MTA_target.pdbqt | data/5W/5W8C-MTA/5W8C-MTA_decoys.pdbqt | data/5W/5W8C-MTA/5W8C-MTA_decoy_scores.csv |
5W2P-TCE | data/5W/5W2P-TCE/5W2P-TCE_ligand.pdbqt | data/5W/5W2P-TCE/5W2P-TCE_target.pdbqt | data/5W/5W2P-TCE/5W2P-TCE_decoys.pdbqt | data/5W/5W2P-TCE/5W2P-TCE_decoy_scores.csv |
5WGK-AGJ | data/5W/5WGK-AGJ/5WGK-AGJ_ligand.pdbqt | data/5W/5WGK-AGJ/5WGK-AGJ_target.pdbqt | data/5W/5WGK-AGJ/5WGK-AGJ_decoys.pdbqt | data/5W/5WGK-AGJ/5WGK-AGJ_decoy_scores.csv |
5WRE-7TL | data/5W/5WRE-7TL/5WRE-7TL_ligand.pdbqt | data/5W/5WRE-7TL/5WRE-7TL_target.pdbqt | data/5W/5WRE-7TL/5WRE-7TL_decoys.pdbqt | data/5W/5WRE-7TL/5WRE-7TL_decoy_scores.csv |
5W0G-1PG | data/5W/5W0G-1PG/5W0G-1PG_ligand.pdbqt | data/5W/5W0G-1PG/5W0G-1PG_target.pdbqt | data/5W/5W0G-1PG/5W0G-1PG_decoys.pdbqt | data/5W/5W0G-1PG/5W0G-1PG_decoy_scores.csv |
5WRJ-A3P | data/5W/5WRJ-A3P/5WRJ-A3P_ligand.pdbqt | data/5W/5WRJ-A3P/5WRJ-A3P_target.pdbqt | data/5W/5WRJ-A3P/5WRJ-A3P_decoys.pdbqt | data/5W/5WRJ-A3P/5WRJ-A3P_decoy_scores.csv |
5WQH-7WU | data/5W/5WQH-7WU/5WQH-7WU_ligand.pdbqt | data/5W/5WQH-7WU/5WQH-7WU_target.pdbqt | data/5W/5WQH-7WU/5WQH-7WU_decoys.pdbqt | data/5W/5WQH-7WU/5WQH-7WU_decoy_scores.csv |
5WDE-ADP | data/5W/5WDE-ADP/5WDE-ADP_ligand.pdbqt | data/5W/5WDE-ADP/5WDE-ADP_target.pdbqt | data/5W/5WDE-ADP/5WDE-ADP_decoys.pdbqt | data/5W/5WDE-ADP/5WDE-ADP_decoy_scores.csv |
5WML-GLU | data/5W/5WML-GLU/5WML-GLU_ligand.pdbqt | data/5W/5WML-GLU/5WML-GLU_target.pdbqt | data/5W/5WML-GLU/5WML-GLU_decoys.pdbqt | data/5W/5WML-GLU/5WML-GLU_decoy_scores.csv |
5WGW-MB5 | data/5W/5WGW-MB5/5WGW-MB5_ligand.pdbqt | data/5W/5WGW-MB5/5WGW-MB5_target.pdbqt | data/5W/5WGW-MB5/5WGW-MB5_decoys.pdbqt | data/5W/5WGW-MB5/5WGW-MB5_decoy_scores.csv |
5WUU-7UU | data/5W/5WUU-7UU/5WUU-7UU_ligand.pdbqt | data/5W/5WUU-7UU/5WUU-7UU_target.pdbqt | data/5W/5WUU-7UU/5WUU-7UU_decoys.pdbqt | data/5W/5WUU-7UU/5WUU-7UU_decoy_scores.csv |
5WLO-GR7 | data/5W/5WLO-GR7/5WLO-GR7_ligand.pdbqt | data/5W/5WLO-GR7/5WLO-GR7_target.pdbqt | data/5W/5WLO-GR7/5WLO-GR7_decoys.pdbqt | data/5W/5WLO-GR7/5WLO-GR7_decoy_scores.csv |
5WFM-KU5 | data/5W/5WFM-KU5/5WFM-KU5_ligand.pdbqt | data/5W/5WFM-KU5/5WFM-KU5_target.pdbqt | data/5W/5WFM-KU5/5WFM-KU5_decoys.pdbqt | data/5W/5WFM-KU5/5WFM-KU5_decoy_scores.csv |
5WS6-BCR | data/5W/5WS6-BCR/5WS6-BCR_ligand.pdbqt | data/5W/5WS6-BCR/5WS6-BCR_target.pdbqt | data/5W/5WS6-BCR/5WS6-BCR_decoys.pdbqt | data/5W/5WS6-BCR/5WS6-BCR_decoy_scores.csv |
5WSB-G6P | data/5W/5WSB-G6P/5WSB-G6P_ligand.pdbqt | data/5W/5WSB-G6P/5WSB-G6P_target.pdbqt | data/5W/5WSB-G6P/5WSB-G6P_decoys.pdbqt | data/5W/5WSB-G6P/5WSB-G6P_decoy_scores.csv |
5W55-X30 | data/5W/5W55-X30/5W55-X30_ligand.pdbqt | data/5W/5W55-X30/5W55-X30_target.pdbqt | data/5W/5W55-X30/5W55-X30_decoys.pdbqt | data/5W/5W55-X30/5W55-X30_decoy_scores.csv |
5W70-9YM | data/5W/5W70-9YM/5W70-9YM_ligand.pdbqt | data/5W/5W70-9YM/5W70-9YM_target.pdbqt | data/5W/5W70-9YM/5W70-9YM_decoys.pdbqt | data/5W/5W70-9YM/5W70-9YM_decoy_scores.csv |
5WRZ-7U3 | data/5W/5WRZ-7U3/5WRZ-7U3_ligand.pdbqt | data/5W/5WRZ-7U3/5WRZ-7U3_target.pdbqt | data/5W/5WRZ-7U3/5WRZ-7U3_decoys.pdbqt | data/5W/5WRZ-7U3/5WRZ-7U3_decoy_scores.csv |
5WIY-1XM | data/5W/5WIY-1XM/5WIY-1XM_ligand.pdbqt | data/5W/5WIY-1XM/5WIY-1XM_target.pdbqt | data/5W/5WIY-1XM/5WIY-1XM_decoys.pdbqt | data/5W/5WIY-1XM/5WIY-1XM_decoy_scores.csv |
5W0F-9U7 | data/5W/5W0F-9U7/5W0F-9U7_ligand.pdbqt | data/5W/5W0F-9U7/5W0F-9U7_target.pdbqt | data/5W/5W0F-9U7/5W0F-9U7_decoys.pdbqt | data/5W/5W0F-9U7/5W0F-9U7_decoy_scores.csv |
5WQG-7MI | data/5W/5WQG-7MI/5WQG-7MI_ligand.pdbqt | data/5W/5WQG-7MI/5WQG-7MI_target.pdbqt | data/5W/5WQG-7MI/5WQG-7MI_decoys.pdbqt | data/5W/5WQG-7MI/5WQG-7MI_decoy_scores.csv |
5WM7-AMP | data/5W/5WM7-AMP/5WM7-AMP_ligand.pdbqt | data/5W/5WM7-AMP/5WM7-AMP_target.pdbqt | data/5W/5WM7-AMP/5WM7-AMP_decoys.pdbqt | data/5W/5WM7-AMP/5WM7-AMP_decoy_scores.csv |
5WIN-SKE | data/5W/5WIN-SKE/5WIN-SKE_ligand.pdbqt | data/5W/5WIN-SKE/5WIN-SKE_target.pdbqt | data/5W/5WIN-SKE/5WIN-SKE_decoys.pdbqt | data/5W/5WIN-SKE/5WIN-SKE_decoy_scores.csv |
5W7K-SAH | data/5W/5W7K-SAH/5W7K-SAH_ligand.pdbqt | data/5W/5W7K-SAH/5W7K-SAH_target.pdbqt | data/5W/5W7K-SAH/5W7K-SAH_decoys.pdbqt | data/5W/5W7K-SAH/5W7K-SAH_decoy_scores.csv |
5W1Y-9SV | data/5W/5W1Y-9SV/5W1Y-9SV_ligand.pdbqt | data/5W/5W1Y-9SV/5W1Y-9SV_target.pdbqt | data/5W/5W1Y-9SV/5W1Y-9SV_decoys.pdbqt | data/5W/5W1Y-9SV/5W1Y-9SV_decoy_scores.csv |
5W0L-9UD | data/5W/5W0L-9UD/5W0L-9UD_ligand.pdbqt | data/5W/5W0L-9UD/5W0L-9UD_target.pdbqt | data/5W/5W0L-9UD/5W0L-9UD_decoys.pdbqt | data/5W/5W0L-9UD/5W0L-9UD_decoy_scores.csv |
5WML-PMP | data/5W/5WML-PMP/5WML-PMP_ligand.pdbqt | data/5W/5WML-PMP/5WML-PMP_target.pdbqt | data/5W/5WML-PMP/5WML-PMP_decoys.pdbqt | data/5W/5WML-PMP/5WML-PMP_decoy_scores.csv |
5W1E-PHB | data/5W/5W1E-PHB/5W1E-PHB_ligand.pdbqt | data/5W/5W1E-PHB/5W1E-PHB_target.pdbqt | data/5W/5W1E-PHB/5W1E-PHB_decoys.pdbqt | data/5W/5W1E-PHB/5W1E-PHB_decoy_scores.csv |
5W4D-PG5 | data/5W/5W4D-PG5/5W4D-PG5_ligand.pdbqt | data/5W/5W4D-PG5/5W4D-PG5_target.pdbqt | data/5W/5W4D-PG5/5W4D-PG5_decoys.pdbqt | data/5W/5W4D-PG5/5W4D-PG5_decoy_scores.csv |
5WHW-BCN | data/5W/5WHW-BCN/5WHW-BCN_ligand.pdbqt | data/5W/5WHW-BCN/5WHW-BCN_target.pdbqt | data/5W/5WHW-BCN/5WHW-BCN_decoys.pdbqt | data/5W/5WHW-BCN/5WHW-BCN_decoy_scores.csv |
5W8A-SAM | data/5W/5W8A-SAM/5W8A-SAM_ligand.pdbqt | data/5W/5W8A-SAM/5W8A-SAM_target.pdbqt | data/5W/5W8A-SAM/5W8A-SAM_decoys.pdbqt | data/5W/5W8A-SAM/5W8A-SAM_decoy_scores.csv |
5WHK-NHE | data/5W/5WHK-NHE/5WHK-NHE_ligand.pdbqt | data/5W/5WHK-NHE/5WHK-NHE_target.pdbqt | data/5W/5WHK-NHE/5WHK-NHE_decoys.pdbqt | data/5W/5WHK-NHE/5WHK-NHE_decoy_scores.csv |
5WGD-EST | data/5W/5WGD-EST/5WGD-EST_ligand.pdbqt | data/5W/5WGD-EST/5WGD-EST_target.pdbqt | data/5W/5WGD-EST/5WGD-EST_decoys.pdbqt | data/5W/5WGD-EST/5WGD-EST_decoy_scores.csv |
5WGL-AH4 | data/5W/5WGL-AH4/5WGL-AH4_ligand.pdbqt | data/5W/5WGL-AH4/5WGL-AH4_target.pdbqt | data/5W/5WGL-AH4/5WGL-AH4_decoys.pdbqt | data/5W/5WGL-AH4/5WGL-AH4_decoy_scores.csv |
5WG9-KU4 | data/5W/5WG9-KU4/5WG9-KU4_ligand.pdbqt | data/5W/5WG9-KU4/5WG9-KU4_target.pdbqt | data/5W/5WG9-KU4/5WG9-KU4_decoys.pdbqt | data/5W/5WG9-KU4/5WG9-KU4_decoy_scores.csv |
5WDH-ADP | data/5W/5WDH-ADP/5WDH-ADP_ligand.pdbqt | data/5W/5WDH-ADP/5WDH-ADP_target.pdbqt | data/5W/5WDH-ADP/5WDH-ADP_decoys.pdbqt | data/5W/5WDH-ADP/5WDH-ADP_decoy_scores.csv |
5W0Q-9UG | data/5W/5W0Q-9UG/5W0Q-9UG_ligand.pdbqt | data/5W/5W0Q-9UG/5W0Q-9UG_target.pdbqt | data/5W/5W0Q-9UG/5W0Q-9UG_decoys.pdbqt | data/5W/5W0Q-9UG/5W0Q-9UG_decoy_scores.csv |
5W6X-APR | data/5W/5W6X-APR/5W6X-APR_ligand.pdbqt | data/5W/5W6X-APR/5W6X-APR_target.pdbqt | data/5W/5W6X-APR/5W6X-APR_decoys.pdbqt | data/5W/5W6X-APR/5W6X-APR_decoy_scores.csv |
5WZN-A2G | data/5W/5WZN-A2G/5WZN-A2G_ligand.pdbqt | data/5W/5WZN-A2G/5WZN-A2G_target.pdbqt | data/5W/5WZN-A2G/5WZN-A2G_decoys.pdbqt | data/5W/5WZN-A2G/5WZN-A2G_decoy_scores.csv |
5W8B-A57 | data/5W/5W8B-A57/5W8B-A57_ligand.pdbqt | data/5W/5W8B-A57/5W8B-A57_target.pdbqt | data/5W/5W8B-A57/5W8B-A57_decoys.pdbqt | data/5W/5W8B-A57/5W8B-A57_decoy_scores.csv |
5WOL-PE3 | data/5W/5WOL-PE3/5WOL-PE3_ligand.pdbqt | data/5W/5WOL-PE3/5WOL-PE3_target.pdbqt | data/5W/5WOL-PE3/5WOL-PE3_decoys.pdbqt | data/5W/5WOL-PE3/5WOL-PE3_decoy_scores.csv |
5WXU-IAC | data/5W/5WXU-IAC/5WXU-IAC_ligand.pdbqt | data/5W/5WXU-IAC/5WXU-IAC_target.pdbqt | data/5W/5WXU-IAC/5WXU-IAC_decoys.pdbqt | data/5W/5WXU-IAC/5WXU-IAC_decoy_scores.csv |
5WLB-GNP | data/5W/5WLB-GNP/5WLB-GNP_ligand.pdbqt | data/5W/5WLB-GNP/5WLB-GNP_target.pdbqt | data/5W/5WLB-GNP/5WLB-GNP_decoys.pdbqt | data/5W/5WLB-GNP/5WLB-GNP_decoy_scores.csv |
5WAU-CHD | data/5W/5WAU-CHD/5WAU-CHD_ligand.pdbqt | data/5W/5WAU-CHD/5WAU-CHD_target.pdbqt | data/5W/5WAU-CHD/5WAU-CHD_decoys.pdbqt | data/5W/5WAU-CHD/5WAU-CHD_decoy_scores.csv |
5WB9-MPO | data/5W/5WB9-MPO/5WB9-MPO_ligand.pdbqt | data/5W/5WB9-MPO/5WB9-MPO_target.pdbqt | data/5W/5WB9-MPO/5WB9-MPO_decoys.pdbqt | data/5W/5WB9-MPO/5WB9-MPO_decoy_scores.csv |
5W2Q-TCE | data/5W/5W2Q-TCE/5W2Q-TCE_ligand.pdbqt | data/5W/5W2Q-TCE/5W2Q-TCE_target.pdbqt | data/5W/5W2Q-TCE/5W2Q-TCE_decoys.pdbqt | data/5W/5W2Q-TCE/5W2Q-TCE_decoy_scores.csv |
5WDC-G2K | data/5W/5WDC-G2K/5WDC-G2K_ligand.pdbqt | data/5W/5WDC-G2K/5WDC-G2K_target.pdbqt | data/5W/5WDC-G2K/5WDC-G2K_decoys.pdbqt | data/5W/5WDC-G2K/5WDC-G2K_decoy_scores.csv |
5W7U-GY8 | data/5W/5W7U-GY8/5W7U-GY8_ligand.pdbqt | data/5W/5W7U-GY8/5W7U-GY8_target.pdbqt | data/5W/5W7U-GY8/5W7U-GY8_decoys.pdbqt | data/5W/5W7U-GY8/5W7U-GY8_decoy_scores.csv |
5WBO-A1Y | data/5W/5WBO-A1Y/5WBO-A1Y_ligand.pdbqt | data/5W/5WBO-A1Y/5WBO-A1Y_target.pdbqt | data/5W/5WBO-A1Y/5WBO-A1Y_decoys.pdbqt | data/5W/5WBO-A1Y/5WBO-A1Y_decoy_scores.csv |
5WAL-9ZS | data/5W/5WAL-9ZS/5WAL-9ZS_ligand.pdbqt | data/5W/5WAL-9ZS/5WAL-9ZS_target.pdbqt | data/5W/5WAL-9ZS/5WAL-9ZS_decoys.pdbqt | data/5W/5WAL-9ZS/5WAL-9ZS_decoy_scores.csv |
5WM4-B5M | data/5W/5WM4-B5M/5WM4-B5M_ligand.pdbqt | data/5W/5WM4-B5M/5WM4-B5M_target.pdbqt | data/5W/5WM4-B5M/5WM4-B5M_decoys.pdbqt | data/5W/5WM4-B5M/5WM4-B5M_decoy_scores.csv |
5WEF-GY6 | data/5W/5WEF-GY6/5WEF-GY6_ligand.pdbqt | data/5W/5WEF-GY6/5WEF-GY6_target.pdbqt | data/5W/5WEF-GY6/5WEF-GY6_decoys.pdbqt | data/5W/5WEF-GY6/5WEF-GY6_decoy_scores.csv |
5WG4-AFV | data/5W/5WG4-AFV/5WG4-AFV_ligand.pdbqt | data/5W/5WG4-AFV/5WG4-AFV_target.pdbqt | data/5W/5WG4-AFV/5WG4-AFV_decoys.pdbqt | data/5W/5WG4-AFV/5WG4-AFV_decoy_scores.csv |
5WC5-AJV | data/5W/5WC5-AJV/5WC5-AJV_ligand.pdbqt | data/5W/5WC5-AJV/5WC5-AJV_target.pdbqt | data/5W/5WC5-AJV/5WC5-AJV_decoys.pdbqt | data/5W/5WC5-AJV/5WC5-AJV_decoy_scores.csv |
5WQC-OLA | data/5W/5WQC-OLA/5WQC-OLA_ligand.pdbqt | data/5W/5WQC-OLA/5WQC-OLA_target.pdbqt | data/5W/5WQC-OLA/5WQC-OLA_decoys.pdbqt | data/5W/5WQC-OLA/5WQC-OLA_decoy_scores.csv |
5WDN-G1K | data/5W/5WDN-G1K/5WDN-G1K_ligand.pdbqt | data/5W/5WDN-G1K/5WDN-G1K_target.pdbqt | data/5W/5WDN-G1K/5WDN-G1K_decoys.pdbqt | data/5W/5WDN-G1K/5WDN-G1K_decoy_scores.csv |
5W8E-SXZ | data/5W/5W8E-SXZ/5W8E-SXZ_ligand.pdbqt | data/5W/5W8E-SXZ/5W8E-SXZ_target.pdbqt | data/5W/5W8E-SXZ/5W8E-SXZ_decoys.pdbqt | data/5W/5W8E-SXZ/5W8E-SXZ_decoy_scores.csv |
5WGG-SAM | data/5W/5WGG-SAM/5WGG-SAM_ligand.pdbqt | data/5W/5WGG-SAM/5WGG-SAM_target.pdbqt | data/5W/5WGG-SAM/5WGG-SAM_decoys.pdbqt | data/5W/5WGG-SAM/5WGG-SAM_decoy_scores.csv |
5W7Q-GDP | data/5W/5W7Q-GDP/5W7Q-GDP_ligand.pdbqt | data/5W/5W7Q-GDP/5W7Q-GDP_target.pdbqt | data/5W/5W7Q-GDP/5W7Q-GDP_decoys.pdbqt | data/5W/5W7Q-GDP/5W7Q-GDP_decoy_scores.csv |
5W8R-9XV | data/5W/5W8R-9XV/5W8R-9XV_ligand.pdbqt | data/5W/5W8R-9XV/5W8R-9XV_target.pdbqt | data/5W/5W8R-9XV/5W8R-9XV_decoys.pdbqt | data/5W/5W8R-9XV/5W8R-9XV_decoy_scores.csv |
5WQI-7X0 | data/5W/5WQI-7X0/5WQI-7X0_ligand.pdbqt | data/5W/5WQI-7X0/5WQI-7X0_target.pdbqt | data/5W/5WQI-7X0/5WQI-7X0_decoys.pdbqt | data/5W/5WQI-7X0/5WQI-7X0_decoy_scores.csv |
5WGU-PM7 | data/5W/5WGU-PM7/5WGU-PM7_ligand.pdbqt | data/5W/5WGU-PM7/5WGU-PM7_target.pdbqt | data/5W/5WGU-PM7/5WGU-PM7_decoys.pdbqt | data/5W/5WGU-PM7/5WGU-PM7_decoy_scores.csv |
5W92-9HD | data/5W/5W92-9HD/5W92-9HD_ligand.pdbqt | data/5W/5W92-9HD/5W92-9HD_target.pdbqt | data/5W/5W92-9HD/5W92-9HD_decoys.pdbqt | data/5W/5W92-9HD/5W92-9HD_decoy_scores.csv |
5WI3-CEF | data/5W/5WI3-CEF/5WI3-CEF_ligand.pdbqt | data/5W/5WI3-CEF/5WI3-CEF_target.pdbqt | data/5W/5WI3-CEF/5WI3-CEF_decoys.pdbqt | data/5W/5WI3-CEF/5WI3-CEF_decoy_scores.csv |
5W44-GY6 | data/5W/5W44-GY6/5W44-GY6_ligand.pdbqt | data/5W/5W44-GY6/5W44-GY6_target.pdbqt | data/5W/5W44-GY6/5W44-GY6_decoys.pdbqt | data/5W/5W44-GY6/5W44-GY6_decoy_scores.csv |
5WDR-GNP | data/5W/5WDR-GNP/5WDR-GNP_ligand.pdbqt | data/5W/5WDR-GNP/5WDR-GNP_target.pdbqt | data/5W/5WDR-GNP/5WDR-GNP_decoys.pdbqt | data/5W/5WDR-GNP/5WDR-GNP_decoy_scores.csv |
5W4Y-FMN | data/5W/5W4Y-FMN/5W4Y-FMN_ligand.pdbqt | data/5W/5W4Y-FMN/5W4Y-FMN_target.pdbqt | data/5W/5W4Y-FMN/5W4Y-FMN_decoys.pdbqt | data/5W/5W4Y-FMN/5W4Y-FMN_decoy_scores.csv |
5WFZ-KU0 | data/5W/5WFZ-KU0/5WFZ-KU0_ligand.pdbqt | data/5W/5WFZ-KU0/5WFZ-KU0_target.pdbqt | data/5W/5WFZ-KU0/5WFZ-KU0_decoys.pdbqt | data/5W/5WFZ-KU0/5WFZ-KU0_decoy_scores.csv |
5WCT-GY4 | data/5W/5WCT-GY4/5WCT-GY4_ligand.pdbqt | data/5W/5WCT-GY4/5WCT-GY4_target.pdbqt | data/5W/5WCT-GY4/5WCT-GY4_decoys.pdbqt | data/5W/5WCT-GY4/5WCT-GY4_decoy_scores.csv |
5WDG-A4Y | data/5W/5WDG-A4Y/5WDG-A4Y_ligand.pdbqt | data/5W/5WDG-A4Y/5WDG-A4Y_target.pdbqt | data/5W/5WDG-A4Y/5WDG-A4Y_decoys.pdbqt | data/5W/5WDG-A4Y/5WDG-A4Y_decoy_scores.csv |
5WHB-GDP | data/5W/5WHB-GDP/5WHB-GDP_ligand.pdbqt | data/5W/5WHB-GDP/5WHB-GDP_target.pdbqt | data/5W/5WHB-GDP/5WHB-GDP_decoys.pdbqt | data/5W/5WHB-GDP/5WHB-GDP_decoy_scores.csv |
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