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 ⌀ |
|---|---|---|---|---|
5M2A-FMN | data/5M/5M2A-FMN/5M2A-FMN_ligand.pdbqt | data/5M/5M2A-FMN/5M2A-FMN_target.pdbqt | data/5M/5M2A-FMN/5M2A-FMN_decoys.pdbqt | data/5M/5M2A-FMN/5M2A-FMN_decoy_scores.csv |
5MWZ-KGU | data/5M/5MWZ-KGU/5MWZ-KGU_ligand.pdbqt | data/5M/5MWZ-KGU/5MWZ-KGU_target.pdbqt | data/5M/5MWZ-KGU/5MWZ-KGU_decoys.pdbqt | data/5M/5MWZ-KGU/5MWZ-KGU_decoy_scores.csv |
5MOV-HC4 | data/5M/5MOV-HC4/5MOV-HC4_ligand.pdbqt | data/5M/5MOV-HC4/5MOV-HC4_target.pdbqt | data/5M/5MOV-HC4/5MOV-HC4_decoys.pdbqt | data/5M/5MOV-HC4/5MOV-HC4_decoy_scores.csv |
5M7S-NHT | data/5M/5M7S-NHT/5M7S-NHT_ligand.pdbqt | data/5M/5M7S-NHT/5M7S-NHT_target.pdbqt | data/5M/5M7S-NHT/5M7S-NHT_decoys.pdbqt | data/5M/5M7S-NHT/5M7S-NHT_decoy_scores.csv |
5MWG-WGX | data/5M/5MWG-WGX/5MWG-WGX_ligand.pdbqt | data/5M/5MWG-WGX/5MWG-WGX_target.pdbqt | data/5M/5MWG-WGX/5MWG-WGX_decoys.pdbqt | data/5M/5MWG-WGX/5MWG-WGX_decoy_scores.csv |
5MRM-Q9T | data/5M/5MRM-Q9T/5MRM-Q9T_ligand.pdbqt | data/5M/5MRM-Q9T/5MRM-Q9T_target.pdbqt | data/5M/5MRM-Q9T/5MRM-Q9T_decoys.pdbqt | data/5M/5MRM-Q9T/5MRM-Q9T_decoy_scores.csv |
5MGW-PHE | data/5M/5MGW-PHE/5MGW-PHE_ligand.pdbqt | data/5M/5MGW-PHE/5MGW-PHE_target.pdbqt | data/5M/5MGW-PHE/5MGW-PHE_decoys.pdbqt | data/5M/5MGW-PHE/5MGW-PHE_decoy_scores.csv |
5MMN-O54 | data/5M/5MMN-O54/5MMN-O54_ligand.pdbqt | data/5M/5MMN-O54/5MMN-O54_target.pdbqt | data/5M/5MMN-O54/5MMN-O54_decoys.pdbqt | data/5M/5MMN-O54/5MMN-O54_decoy_scores.csv |
5MAT-7KJ | data/5M/5MAT-7KJ/5MAT-7KJ_ligand.pdbqt | data/5M/5MAT-7KJ/5MAT-7KJ_target.pdbqt | data/5M/5MAT-7KJ/5MAT-7KJ_decoys.pdbqt | data/5M/5MAT-7KJ/5MAT-7KJ_decoy_scores.csv |
5M8G-GTP | data/5M/5M8G-GTP/5M8G-GTP_ligand.pdbqt | data/5M/5M8G-GTP/5M8G-GTP_target.pdbqt | data/5M/5M8G-GTP/5M8G-GTP_decoys.pdbqt | data/5M/5M8G-GTP/5M8G-GTP_decoy_scores.csv |
5M4M-TF3 | data/5M/5M4M-TF3/5M4M-TF3_ligand.pdbqt | data/5M/5M4M-TF3/5M4M-TF3_target.pdbqt | data/5M/5M4M-TF3/5M4M-TF3_decoys.pdbqt | data/5M/5M4M-TF3/5M4M-TF3_decoy_scores.csv |
5M7G-FB7 | data/5M/5M7G-FB7/5M7G-FB7_ligand.pdbqt | data/5M/5M7G-FB7/5M7G-FB7_target.pdbqt | data/5M/5M7G-FB7/5M7G-FB7_decoys.pdbqt | data/5M/5M7G-FB7/5M7G-FB7_decoy_scores.csv |
5MT3-SRO | data/5M/5MT3-SRO/5MT3-SRO_ligand.pdbqt | data/5M/5MT3-SRO/5MT3-SRO_target.pdbqt | data/5M/5MT3-SRO/5MT3-SRO_decoys.pdbqt | data/5M/5MT3-SRO/5MT3-SRO_decoy_scores.csv |
5M2G-BEN | data/5M/5M2G-BEN/5M2G-BEN_ligand.pdbqt | data/5M/5M2G-BEN/5M2G-BEN_target.pdbqt | data/5M/5M2G-BEN/5M2G-BEN_decoys.pdbqt | data/5M/5M2G-BEN/5M2G-BEN_decoy_scores.csv |
5MRB-C5N | data/5M/5MRB-C5N/5MRB-C5N_ligand.pdbqt | data/5M/5MRB-C5N/5MRB-C5N_target.pdbqt | data/5M/5MRB-C5N/5MRB-C5N_decoys.pdbqt | data/5M/5MRB-C5N/5MRB-C5N_decoy_scores.csv |
5M2G-TBP | data/5M/5M2G-TBP/5M2G-TBP_ligand.pdbqt | data/5M/5M2G-TBP/5M2G-TBP_target.pdbqt | data/5M/5M2G-TBP/5M2G-TBP_decoys.pdbqt | data/5M/5M2G-TBP/5M2G-TBP_decoy_scores.csv |
5M3A-7E7 | data/5M/5M3A-7E7/5M3A-7E7_ligand.pdbqt | data/5M/5M3A-7E7/5M3A-7E7_target.pdbqt | data/5M/5M3A-7E7/5M3A-7E7_decoys.pdbqt | data/5M/5M3A-7E7/5M3A-7E7_decoy_scores.csv |
5MLH-XOG | data/5M/5MLH-XOG/5MLH-XOG_ligand.pdbqt | data/5M/5MLH-XOG/5MLH-XOG_target.pdbqt | data/5M/5MLH-XOG/5MLH-XOG_decoys.pdbqt | data/5M/5MLH-XOG/5MLH-XOG_decoy_scores.csv |
5M7E-GDP | data/5M/5M7E-GDP/5M7E-GDP_ligand.pdbqt | data/5M/5M7E-GDP/5M7E-GDP_target.pdbqt | data/5M/5M7E-GDP/5M7E-GDP_decoys.pdbqt | data/5M/5M7E-GDP/5M7E-GDP_decoy_scores.csv |
5MYW-WCU | data/5M/5MYW-WCU/5MYW-WCU_ligand.pdbqt | data/5M/5MYW-WCU/5MYW-WCU_target.pdbqt | data/5M/5MYW-WCU/5MYW-WCU_decoys.pdbqt | data/5M/5MYW-WCU/5MYW-WCU_decoy_scores.csv |
5M5B-SAM | data/5M/5M5B-SAM/5M5B-SAM_ligand.pdbqt | data/5M/5M5B-SAM/5M5B-SAM_target.pdbqt | data/5M/5M5B-SAM/5M5B-SAM_decoys.pdbqt | data/5M/5M5B-SAM/5M5B-SAM_decoy_scores.csv |
5M65-NAD | data/5M/5M65-NAD/5M65-NAD_ligand.pdbqt | data/5M/5M65-NAD/5M65-NAD_target.pdbqt | data/5M/5M65-NAD/5M65-NAD_decoys.pdbqt | data/5M/5M65-NAD/5M65-NAD_decoy_scores.csv |
5M4P-TF3 | data/5M/5M4P-TF3/5M4P-TF3_ligand.pdbqt | data/5M/5M4P-TF3/5M4P-TF3_target.pdbqt | data/5M/5M4P-TF3/5M4P-TF3_decoys.pdbqt | data/5M/5M4P-TF3/5M4P-TF3_decoy_scores.csv |
5MAZ-FUL | data/5M/5MAZ-FUL/5MAZ-FUL_ligand.pdbqt | data/5M/5MAZ-FUL/5MAZ-FUL_target.pdbqt | data/5M/5MAZ-FUL/5MAZ-FUL_decoys.pdbqt | data/5M/5MAZ-FUL/5MAZ-FUL_decoy_scores.csv |
5MUE-VIV | data/5M/5MUE-VIV/5MUE-VIV_ligand.pdbqt | data/5M/5MUE-VIV/5MUE-VIV_target.pdbqt | data/5M/5MUE-VIV/5MUE-VIV_decoys.pdbqt | data/5M/5MUE-VIV/5MUE-VIV_decoy_scores.csv |
5MQY-GH4 | data/5M/5MQY-GH4/5MQY-GH4_ligand.pdbqt | data/5M/5MQY-GH4/5MQY-GH4_target.pdbqt | data/5M/5MQY-GH4/5MQY-GH4_decoys.pdbqt | data/5M/5MQY-GH4/5MQY-GH4_decoy_scores.csv |
5M6V-H52 | data/5M/5M6V-H52/5M6V-H52_ligand.pdbqt | data/5M/5M6V-H52/5M6V-H52_target.pdbqt | data/5M/5M6V-H52/5M6V-H52_decoys.pdbqt | data/5M/5M6V-H52/5M6V-H52_decoy_scores.csv |
5MSS-AMP | data/5M/5MSS-AMP/5MSS-AMP_ligand.pdbqt | data/5M/5MSS-AMP/5MSS-AMP_target.pdbqt | data/5M/5MSS-AMP/5MSS-AMP_decoys.pdbqt | data/5M/5MSS-AMP/5MSS-AMP_decoy_scores.csv |
5MOH-YTX | data/5M/5MOH-YTX/5MOH-YTX_ligand.pdbqt | data/5M/5MOH-YTX/5MOH-YTX_target.pdbqt | data/5M/5MOH-YTX/5MOH-YTX_decoys.pdbqt | data/5M/5MOH-YTX/5MOH-YTX_decoy_scores.csv |
5ML3-DL3 | data/5M/5ML3-DL3/5ML3-DL3_ligand.pdbqt | data/5M/5ML3-DL3/5ML3-DL3_target.pdbqt | data/5M/5ML3-DL3/5ML3-DL3_decoys.pdbqt | data/5M/5ML3-DL3/5ML3-DL3_decoy_scores.csv |
5M7G-GDP | data/5M/5M7G-GDP/5M7G-GDP_ligand.pdbqt | data/5M/5M7G-GDP/5M7G-GDP_target.pdbqt | data/5M/5M7G-GDP/5M7G-GDP_decoys.pdbqt | data/5M/5M7G-GDP/5M7G-GDP_decoy_scores.csv |
5MZJ-OLA | data/5M/5MZJ-OLA/5MZJ-OLA_ligand.pdbqt | data/5M/5MZJ-OLA/5MZJ-OLA_target.pdbqt | data/5M/5MZJ-OLA/5MZJ-OLA_decoys.pdbqt | data/5M/5MZJ-OLA/5MZJ-OLA_decoy_scores.csv |
5MW8-5MY | data/5M/5MW8-5MY/5MW8-5MY_ligand.pdbqt | data/5M/5MW8-5MY/5MW8-5MY_target.pdbqt | data/5M/5MW8-5MY/5MW8-5MY_decoys.pdbqt | data/5M/5MW8-5MY/5MW8-5MY_decoy_scores.csv |
5MEX-SZZ | data/5M/5MEX-SZZ/5MEX-SZZ_ligand.pdbqt | data/5M/5MEX-SZZ/5MEX-SZZ_target.pdbqt | data/5M/5MEX-SZZ/5MEX-SZZ_decoys.pdbqt | data/5M/5MEX-SZZ/5MEX-SZZ_decoy_scores.csv |
5M67-NAD | data/5M/5M67-NAD/5M67-NAD_ligand.pdbqt | data/5M/5M67-NAD/5M67-NAD_target.pdbqt | data/5M/5M67-NAD/5M67-NAD_decoys.pdbqt | data/5M/5M67-NAD/5M67-NAD_decoy_scores.csv |
5MI6-7NQ | data/5M/5MI6-7NQ/5MI6-7NQ_ligand.pdbqt | data/5M/5MI6-7NQ/5MI6-7NQ_target.pdbqt | data/5M/5MI6-7NQ/5MI6-7NQ_decoys.pdbqt | data/5M/5MI6-7NQ/5MI6-7NQ_decoy_scores.csv |
5MFQ-2J9 | data/5M/5MFQ-2J9/5MFQ-2J9_ligand.pdbqt | data/5M/5MFQ-2J9/5MFQ-2J9_target.pdbqt | data/5M/5MFQ-2J9/5MFQ-2J9_decoys.pdbqt | data/5M/5MFQ-2J9/5MFQ-2J9_decoy_scores.csv |
5M25-7DU | data/5M/5M25-7DU/5M25-7DU_ligand.pdbqt | data/5M/5M25-7DU/5M25-7DU_target.pdbqt | data/5M/5M25-7DU/5M25-7DU_decoys.pdbqt | data/5M/5M25-7DU/5M25-7DU_decoy_scores.csv |
5MTJ-CXS | data/5M/5MTJ-CXS/5MTJ-CXS_ligand.pdbqt | data/5M/5MTJ-CXS/5MTJ-CXS_target.pdbqt | data/5M/5MTJ-CXS/5MTJ-CXS_decoys.pdbqt | data/5M/5MTJ-CXS/5MTJ-CXS_decoy_scores.csv |
5MZP-CFF | data/5M/5MZP-CFF/5MZP-CFF_ligand.pdbqt | data/5M/5MZP-CFF/5MZP-CFF_target.pdbqt | data/5M/5MZP-CFF/5MZP-CFF_decoys.pdbqt | data/5M/5MZP-CFF/5MZP-CFF_decoy_scores.csv |
5MGE-7MX | data/5M/5MGE-7MX/5MGE-7MX_ligand.pdbqt | data/5M/5MGE-7MX/5MGE-7MX_target.pdbqt | data/5M/5MGE-7MX/5MGE-7MX_decoys.pdbqt | data/5M/5MGE-7MX/5MGE-7MX_decoy_scores.csv |
5MXC-MFU | data/5M/5MXC-MFU/5MXC-MFU_ligand.pdbqt | data/5M/5MXC-MFU/5MXC-MFU_target.pdbqt | data/5M/5MXC-MFU/5MXC-MFU_decoys.pdbqt | data/5M/5MXC-MFU/5MXC-MFU_decoy_scores.csv |
5M4B-7F7 | data/5M/5M4B-7F7/5M4B-7F7_ligand.pdbqt | data/5M/5M4B-7F7/5M4B-7F7_target.pdbqt | data/5M/5M4B-7F7/5M4B-7F7_decoys.pdbqt | data/5M/5M4B-7F7/5M4B-7F7_decoy_scores.csv |
5MB1-FLC | data/5M/5MB1-FLC/5MB1-FLC_ligand.pdbqt | data/5M/5MB1-FLC/5MB1-FLC_target.pdbqt | data/5M/5MB1-FLC/5MB1-FLC_decoys.pdbqt | data/5M/5MB1-FLC/5MB1-FLC_decoy_scores.csv |
5MU6-KFK | data/5M/5MU6-KFK/5MU6-KFK_ligand.pdbqt | data/5M/5MU6-KFK/5MU6-KFK_target.pdbqt | data/5M/5MU6-KFK/5MU6-KFK_decoys.pdbqt | data/5M/5MU6-KFK/5MU6-KFK_decoy_scores.csv |
5MUT-FMN | data/5M/5MUT-FMN/5MUT-FMN_ligand.pdbqt | data/5M/5MUT-FMN/5MUT-FMN_target.pdbqt | data/5M/5MUT-FMN/5MUT-FMN_decoys.pdbqt | data/5M/5MUT-FMN/5MUT-FMN_decoy_scores.csv |
5MJI-7O6 | data/5M/5MJI-7O6/5MJI-7O6_ligand.pdbqt | data/5M/5MJI-7O6/5MJI-7O6_target.pdbqt | data/5M/5MJI-7O6/5MJI-7O6_decoys.pdbqt | data/5M/5MJI-7O6/5MJI-7O6_decoy_scores.csv |
5MPQ-BLG | data/5M/5MPQ-BLG/5MPQ-BLG_ligand.pdbqt | data/5M/5MPQ-BLG/5MPQ-BLG_target.pdbqt | data/5M/5MPQ-BLG/5MPQ-BLG_decoys.pdbqt | data/5M/5MPQ-BLG/5MPQ-BLG_decoy_scores.csv |
5M9N-2MR | data/5M/5M9N-2MR/5M9N-2MR_ligand.pdbqt | data/5M/5M9N-2MR/5M9N-2MR_target.pdbqt | data/5M/5M9N-2MR/5M9N-2MR_decoys.pdbqt | data/5M/5M9N-2MR/5M9N-2MR_decoy_scores.csv |
5MGH-PHE | data/5M/5MGH-PHE/5MGH-PHE_ligand.pdbqt | data/5M/5MGH-PHE/5MGH-PHE_target.pdbqt | data/5M/5MGH-PHE/5MGH-PHE_decoys.pdbqt | data/5M/5MGH-PHE/5MGH-PHE_decoy_scores.csv |
5ML6-9GD | data/5M/5ML6-9GD/5ML6-9GD_ligand.pdbqt | data/5M/5ML6-9GD/5ML6-9GD_target.pdbqt | data/5M/5ML6-9GD/5ML6-9GD_decoys.pdbqt | data/5M/5ML6-9GD/5ML6-9GD_decoy_scores.csv |
5MDO-C8E | data/5M/5MDO-C8E/5MDO-C8E_ligand.pdbqt | data/5M/5MDO-C8E/5MDO-C8E_target.pdbqt | data/5M/5MDO-C8E/5MDO-C8E_decoys.pdbqt | data/5M/5MDO-C8E/5MDO-C8E_decoy_scores.csv |
5M7C-UDP | data/5M/5M7C-UDP/5M7C-UDP_ligand.pdbqt | data/5M/5M7C-UDP/5M7C-UDP_target.pdbqt | data/5M/5M7C-UDP/5M7C-UDP_decoys.pdbqt | data/5M/5M7C-UDP/5M7C-UDP_decoy_scores.csv |
5MXB-ML1 | data/5M/5MXB-ML1/5MXB-ML1_ligand.pdbqt | data/5M/5MXB-ML1/5MXB-ML1_target.pdbqt | data/5M/5MXB-ML1/5MXB-ML1_decoys.pdbqt | data/5M/5MXB-ML1/5MXB-ML1_decoy_scores.csv |
5M0L-7CT | data/5M/5M0L-7CT/5M0L-7CT_ligand.pdbqt | data/5M/5M0L-7CT/5M0L-7CT_target.pdbqt | data/5M/5M0L-7CT/5M0L-7CT_decoys.pdbqt | data/5M/5M0L-7CT/5M0L-7CT_decoy_scores.csv |
5M53-7GJ | data/5M/5M53-7GJ/5M53-7GJ_ligand.pdbqt | data/5M/5M53-7GJ/5M53-7GJ_target.pdbqt | data/5M/5M53-7GJ/5M53-7GJ_decoys.pdbqt | data/5M/5M53-7GJ/5M53-7GJ_decoy_scores.csv |
5MSC-AMP | data/5M/5MSC-AMP/5MSC-AMP_ligand.pdbqt | data/5M/5MSC-AMP/5MSC-AMP_target.pdbqt | data/5M/5MSC-AMP/5MSC-AMP_decoys.pdbqt | data/5M/5MSC-AMP/5MSC-AMP_decoy_scores.csv |
5MZG-2GE | data/5M/5MZG-2GE/5MZG-2GE_ligand.pdbqt | data/5M/5MZG-2GE/5MZG-2GE_target.pdbqt | data/5M/5MZG-2GE/5MZG-2GE_decoys.pdbqt | data/5M/5MZG-2GE/5MZG-2GE_decoy_scores.csv |
5MZP-CLR | data/5M/5MZP-CLR/5MZP-CLR_ligand.pdbqt | data/5M/5MZP-CLR/5MZP-CLR_target.pdbqt | data/5M/5MZP-CLR/5MZP-CLR_decoys.pdbqt | data/5M/5MZP-CLR/5MZP-CLR_decoy_scores.csv |
5MPK-0BC | data/5M/5MPK-0BC/5MPK-0BC_ligand.pdbqt | data/5M/5MPK-0BC/5MPK-0BC_target.pdbqt | data/5M/5MPK-0BC/5MPK-0BC_decoys.pdbqt | data/5M/5MPK-0BC/5MPK-0BC_decoy_scores.csv |
5MF5-C2E | data/5M/5MF5-C2E/5MF5-C2E_ligand.pdbqt | data/5M/5MF5-C2E/5MF5-C2E_target.pdbqt | data/5M/5MF5-C2E/5MF5-C2E_decoys.pdbqt | data/5M/5MF5-C2E/5MF5-C2E_decoy_scores.csv |
5M62-P6G | data/5M/5M62-P6G/5M62-P6G_ligand.pdbqt | data/5M/5M62-P6G/5M62-P6G_target.pdbqt | data/5M/5M62-P6G/5M62-P6G_decoys.pdbqt | data/5M/5M62-P6G/5M62-P6G_decoy_scores.csv |
5MA1-T6C | data/5M/5MA1-T6C/5MA1-T6C_ligand.pdbqt | data/5M/5MA1-T6C/5MA1-T6C_target.pdbqt | data/5M/5MA1-T6C/5MA1-T6C_decoys.pdbqt | data/5M/5MA1-T6C/5MA1-T6C_decoy_scores.csv |
5MLI-82I | data/5M/5MLI-82I/5MLI-82I_ligand.pdbqt | data/5M/5MLI-82I/5MLI-82I_target.pdbqt | data/5M/5MLI-82I/5MLI-82I_decoys.pdbqt | data/5M/5MLI-82I/5MLI-82I_decoy_scores.csv |
5MT3-ARG | data/5M/5MT3-ARG/5MT3-ARG_ligand.pdbqt | data/5M/5MT3-ARG/5MT3-ARG_target.pdbqt | data/5M/5MT3-ARG/5MT3-ARG_decoys.pdbqt | data/5M/5MT3-ARG/5MT3-ARG_decoy_scores.csv |
5MF4-ACP | data/5M/5MF4-ACP/5MF4-ACP_ligand.pdbqt | data/5M/5MF4-ACP/5MF4-ACP_target.pdbqt | data/5M/5MF4-ACP/5MF4-ACP_decoys.pdbqt | data/5M/5MF4-ACP/5MF4-ACP_decoy_scores.csv |
5MFQ-KAI | data/5M/5MFQ-KAI/5MFQ-KAI_ligand.pdbqt | data/5M/5MFQ-KAI/5MFQ-KAI_target.pdbqt | data/5M/5MFQ-KAI/5MFQ-KAI_decoys.pdbqt | data/5M/5MFQ-KAI/5MFQ-KAI_decoy_scores.csv |
5MZY-8EZ | data/5M/5MZY-8EZ/5MZY-8EZ_ligand.pdbqt | data/5M/5MZY-8EZ/5MZY-8EZ_target.pdbqt | data/5M/5MZY-8EZ/5MZY-8EZ_decoys.pdbqt | data/5M/5MZY-8EZ/5MZY-8EZ_decoy_scores.csv |
5M7B-UDP | data/5M/5M7B-UDP/5M7B-UDP_ligand.pdbqt | data/5M/5M7B-UDP/5M7B-UDP_target.pdbqt | data/5M/5M7B-UDP/5M7B-UDP_decoys.pdbqt | data/5M/5M7B-UDP/5M7B-UDP_decoy_scores.csv |
5MW2-U52 | data/5M/5MW2-U52/5MW2-U52_ligand.pdbqt | data/5M/5MW2-U52/5MW2-U52_target.pdbqt | data/5M/5MW2-U52/5MW2-U52_decoys.pdbqt | data/5M/5MW2-U52/5MW2-U52_decoy_scores.csv |
5MHI-7N9 | data/5M/5MHI-7N9/5MHI-7N9_ligand.pdbqt | data/5M/5MHI-7N9/5MHI-7N9_target.pdbqt | data/5M/5MHI-7N9/5MHI-7N9_decoys.pdbqt | data/5M/5MHI-7N9/5MHI-7N9_decoy_scores.csv |
5M1A-MUR | data/5M/5M1A-MUR/5M1A-MUR_ligand.pdbqt | data/5M/5M1A-MUR/5M1A-MUR_target.pdbqt | data/5M/5M1A-MUR/5M1A-MUR_decoys.pdbqt | data/5M/5M1A-MUR/5M1A-MUR_decoy_scores.csv |
5MT6-BNG | data/5M/5MT6-BNG/5MT6-BNG_ligand.pdbqt | data/5M/5MT6-BNG/5MT6-BNG_target.pdbqt | data/5M/5MT6-BNG/5MT6-BNG_decoys.pdbqt | data/5M/5MT6-BNG/5MT6-BNG_decoy_scores.csv |
5M90-JIF | data/5M/5M90-JIF/5M90-JIF_ligand.pdbqt | data/5M/5M90-JIF/5M90-JIF_target.pdbqt | data/5M/5M90-JIF/5M90-JIF_decoys.pdbqt | data/5M/5M90-JIF/5M90-JIF_decoy_scores.csv |
5MGN-AR6 | data/5M/5MGN-AR6/5MGN-AR6_ligand.pdbqt | data/5M/5MGN-AR6/5MGN-AR6_target.pdbqt | data/5M/5MGN-AR6/5MGN-AR6_decoys.pdbqt | data/5M/5MGN-AR6/5MGN-AR6_decoy_scores.csv |
5MM6-32U | data/5M/5MM6-32U/5MM6-32U_ligand.pdbqt | data/5M/5MM6-32U/5MM6-32U_target.pdbqt | data/5M/5MM6-32U/5MM6-32U_decoys.pdbqt | data/5M/5MM6-32U/5MM6-32U_decoy_scores.csv |
5MIH-ETE | data/5M/5MIH-ETE/5MIH-ETE_ligand.pdbqt | data/5M/5MIH-ETE/5MIH-ETE_target.pdbqt | data/5M/5MIH-ETE/5MIH-ETE_decoys.pdbqt | data/5M/5MIH-ETE/5MIH-ETE_decoy_scores.csv |
5MI5-OAN | data/5M/5MI5-OAN/5MI5-OAN_ligand.pdbqt | data/5M/5MI5-OAN/5MI5-OAN_target.pdbqt | data/5M/5MI5-OAN/5MI5-OAN_decoys.pdbqt | data/5M/5MI5-OAN/5MI5-OAN_decoy_scores.csv |
5M5F-7GR | data/5M/5M5F-7GR/5M5F-7GR_ligand.pdbqt | data/5M/5M5F-7GR/5M5F-7GR_target.pdbqt | null | null |
5MF4-GDP | data/5M/5MF4-GDP/5MF4-GDP_ligand.pdbqt | data/5M/5MF4-GDP/5MF4-GDP_target.pdbqt | data/5M/5MF4-GDP/5MF4-GDP_decoys.pdbqt | data/5M/5MF4-GDP/5MF4-GDP_decoy_scores.csv |
5MQK-QPR | data/5M/5MQK-QPR/5MQK-QPR_ligand.pdbqt | data/5M/5MQK-QPR/5MQK-QPR_target.pdbqt | data/5M/5MQK-QPR/5MQK-QPR_decoys.pdbqt | data/5M/5MQK-QPR/5MQK-QPR_decoy_scores.csv |
5MEX-PAP | data/5M/5MEX-PAP/5MEX-PAP_ligand.pdbqt | data/5M/5MEX-PAP/5MEX-PAP_target.pdbqt | data/5M/5MEX-PAP/5MEX-PAP_decoys.pdbqt | data/5M/5MEX-PAP/5MEX-PAP_decoy_scores.csv |
5M7W-WZO | data/5M/5M7W-WZO/5M7W-WZO_ligand.pdbqt | data/5M/5M7W-WZO/5M7W-WZO_target.pdbqt | data/5M/5M7W-WZO/5M7W-WZO_decoys.pdbqt | data/5M/5M7W-WZO/5M7W-WZO_decoy_scores.csv |
5M8D-GTP | data/5M/5M8D-GTP/5M8D-GTP_ligand.pdbqt | data/5M/5M8D-GTP/5M8D-GTP_target.pdbqt | data/5M/5M8D-GTP/5M8D-GTP_decoys.pdbqt | data/5M/5M8D-GTP/5M8D-GTP_decoy_scores.csv |
5MMG-UT0 | data/5M/5MMG-UT0/5MMG-UT0_ligand.pdbqt | data/5M/5MMG-UT0/5MMG-UT0_target.pdbqt | data/5M/5MMG-UT0/5MMG-UT0_decoys.pdbqt | data/5M/5MMG-UT0/5MMG-UT0_decoy_scores.csv |
5MCB-CGG | data/5M/5MCB-CGG/5MCB-CGG_ligand.pdbqt | data/5M/5MCB-CGG/5MCB-CGG_target.pdbqt | data/5M/5MCB-CGG/5MCB-CGG_decoys.pdbqt | data/5M/5MCB-CGG/5MCB-CGG_decoy_scores.csv |
5M9W-7GR | data/5M/5M9W-7GR/5M9W-7GR_ligand.pdbqt | data/5M/5M9W-7GR/5M9W-7GR_target.pdbqt | data/5M/5M9W-7GR/5M9W-7GR_decoys.pdbqt | data/5M/5M9W-7GR/5M9W-7GR_decoy_scores.csv |
5MYG-LS8 | data/5M/5MYG-LS8/5MYG-LS8_ligand.pdbqt | data/5M/5MYG-LS8/5MYG-LS8_target.pdbqt | data/5M/5MYG-LS8/5MYG-LS8_decoys.pdbqt | data/5M/5MYG-LS8/5MYG-LS8_decoy_scores.csv |
5M04-GDP | data/5M/5M04-GDP/5M04-GDP_ligand.pdbqt | data/5M/5M04-GDP/5M04-GDP_target.pdbqt | data/5M/5M04-GDP/5M04-GDP_decoys.pdbqt | data/5M/5M04-GDP/5M04-GDP_decoy_scores.csv |
5M4O-NPO | data/5M/5M4O-NPO/5M4O-NPO_ligand.pdbqt | data/5M/5M4O-NPO/5M4O-NPO_target.pdbqt | data/5M/5M4O-NPO/5M4O-NPO_decoys.pdbqt | data/5M/5M4O-NPO/5M4O-NPO_decoy_scores.csv |
5MTX-FJI | data/5M/5MTX-FJI/5MTX-FJI_ligand.pdbqt | data/5M/5MTX-FJI/5MTX-FJI_target.pdbqt | data/5M/5MTX-FJI/5MTX-FJI_decoys.pdbqt | data/5M/5MTX-FJI/5MTX-FJI_decoy_scores.csv |
5M24-9CR | data/5M/5M24-9CR/5M24-9CR_ligand.pdbqt | data/5M/5M24-9CR/5M24-9CR_target.pdbqt | data/5M/5M24-9CR/5M24-9CR_decoys.pdbqt | data/5M/5M24-9CR/5M24-9CR_decoy_scores.csv |
5MT9-SRO | data/5M/5MT9-SRO/5MT9-SRO_ligand.pdbqt | data/5M/5MT9-SRO/5MT9-SRO_target.pdbqt | data/5M/5MT9-SRO/5MT9-SRO_decoys.pdbqt | data/5M/5MT9-SRO/5MT9-SRO_decoy_scores.csv |
5MRL-F2M | data/5M/5MRL-F2M/5MRL-F2M_ligand.pdbqt | data/5M/5MRL-F2M/5MRL-F2M_target.pdbqt | data/5M/5MRL-F2M/5MRL-F2M_decoys.pdbqt | data/5M/5MRL-F2M/5MRL-F2M_decoy_scores.csv |
5M55-7GG | data/5M/5M55-7GG/5M55-7GG_ligand.pdbqt | data/5M/5M55-7GG/5M55-7GG_target.pdbqt | data/5M/5M55-7GG/5M55-7GG_decoys.pdbqt | data/5M/5M55-7GG/5M55-7GG_decoy_scores.csv |
5M39-7EA | data/5M/5M39-7EA/5M39-7EA_ligand.pdbqt | data/5M/5M39-7EA/5M39-7EA_target.pdbqt | data/5M/5M39-7EA/5M39-7EA_decoys.pdbqt | data/5M/5M39-7EA/5M39-7EA_decoy_scores.csv |
5MZL-8ET | data/5M/5MZL-8ET/5MZL-8ET_ligand.pdbqt | data/5M/5MZL-8ET/5MZL-8ET_target.pdbqt | data/5M/5MZL-8ET/5MZL-8ET_decoys.pdbqt | data/5M/5MZL-8ET/5MZL-8ET_decoy_scores.csv |
5MPN-YE5 | data/5M/5MPN-YE5/5MPN-YE5_ligand.pdbqt | data/5M/5MPN-YE5/5MPN-YE5_target.pdbqt | data/5M/5MPN-YE5/5MPN-YE5_decoys.pdbqt | data/5M/5MPN-YE5/5MPN-YE5_decoy_scores.csv |
5MAI-5U5 | data/5M/5MAI-5U5/5MAI-5U5_ligand.pdbqt | data/5M/5MAI-5U5/5MAI-5U5_target.pdbqt | data/5M/5MAI-5U5/5MAI-5U5_decoys.pdbqt | data/5M/5MAI-5U5/5MAI-5U5_decoy_scores.csv |
5M19-MUR | data/5M/5M19-MUR/5M19-MUR_ligand.pdbqt | data/5M/5M19-MUR/5M19-MUR_target.pdbqt | data/5M/5M19-MUR/5M19-MUR_decoys.pdbqt | data/5M/5M19-MUR/5M19-MUR_decoy_scores.csv |
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