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 ⌀ |
|---|---|---|---|---|
4REL-KMP | data/4R/4REL-KMP/4REL-KMP_ligand.pdbqt | data/4R/4REL-KMP/4REL-KMP_target.pdbqt | data/4R/4REL-KMP/4REL-KMP_decoys.pdbqt | data/4R/4REL-KMP/4REL-KMP_decoy_scores.csv |
4RWJ-66T | data/4R/4RWJ-66T/4RWJ-66T_ligand.pdbqt | data/4R/4RWJ-66T/4RWJ-66T_target.pdbqt | data/4R/4RWJ-66T/4RWJ-66T_decoys.pdbqt | data/4R/4RWJ-66T/4RWJ-66T_decoy_scores.csv |
4RGB-NAD | data/4R/4RGB-NAD/4RGB-NAD_ligand.pdbqt | data/4R/4RGB-NAD/4RGB-NAD_target.pdbqt | data/4R/4RGB-NAD/4RGB-NAD_decoys.pdbqt | data/4R/4RGB-NAD/4RGB-NAD_decoy_scores.csv |
4RE8-3MJ | data/4R/4RE8-3MJ/4RE8-3MJ_ligand.pdbqt | data/4R/4RE8-3MJ/4RE8-3MJ_target.pdbqt | data/4R/4RE8-3MJ/4RE8-3MJ_decoys.pdbqt | data/4R/4RE8-3MJ/4RE8-3MJ_decoy_scores.csv |
4R8H-SP1 | data/4R/4R8H-SP1/4R8H-SP1_ligand.pdbqt | data/4R/4R8H-SP1/4R8H-SP1_target.pdbqt | data/4R/4R8H-SP1/4R8H-SP1_decoys.pdbqt | data/4R/4R8H-SP1/4R8H-SP1_decoy_scores.csv |
5EZ1-ICB | data/5E/5EZ1-ICB/5EZ1-ICB_ligand.pdbqt | data/5E/5EZ1-ICB/5EZ1-ICB_target.pdbqt | data/5E/5EZ1-ICB/5EZ1-ICB_decoys.pdbqt | data/5E/5EZ1-ICB/5EZ1-ICB_decoy_scores.csv |
5EKB-PLM | data/5E/5EKB-PLM/5EKB-PLM_ligand.pdbqt | data/5E/5EKB-PLM/5EKB-PLM_target.pdbqt | data/5E/5EKB-PLM/5EKB-PLM_decoys.pdbqt | data/5E/5EKB-PLM/5EKB-PLM_decoy_scores.csv |
5EHZ-5NZ | data/5E/5EHZ-5NZ/5EHZ-5NZ_ligand.pdbqt | data/5E/5EHZ-5NZ/5EHZ-5NZ_target.pdbqt | data/5E/5EHZ-5NZ/5EHZ-5NZ_decoys.pdbqt | data/5E/5EHZ-5NZ/5EHZ-5NZ_decoy_scores.csv |
5EPE-SAH | data/5E/5EPE-SAH/5EPE-SAH_ligand.pdbqt | data/5E/5EPE-SAH/5EPE-SAH_target.pdbqt | data/5E/5EPE-SAH/5EPE-SAH_decoys.pdbqt | data/5E/5EPE-SAH/5EPE-SAH_decoy_scores.csv |
5E14-5KB | data/5E/5E14-5KB/5E14-5KB_ligand.pdbqt | data/5E/5E14-5KB/5E14-5KB_target.pdbqt | data/5E/5E14-5KB/5E14-5KB_decoys.pdbqt | data/5E/5E14-5KB/5E14-5KB_decoy_scores.csv |
5E9V-5L0 | data/5E/5E9V-5L0/5E9V-5L0_ligand.pdbqt | data/5E/5E9V-5L0/5E9V-5L0_target.pdbqt | data/5E/5E9V-5L0/5E9V-5L0_decoys.pdbqt | data/5E/5E9V-5L0/5E9V-5L0_decoy_scores.csv |
5EQT-ADP | data/5E/5EQT-ADP/5EQT-ADP_ligand.pdbqt | data/5E/5EQT-ADP/5EQT-ADP_target.pdbqt | data/5E/5EQT-ADP/5EQT-ADP_decoys.pdbqt | data/5E/5EQT-ADP/5EQT-ADP_decoy_scores.csv |
5E3I-HIS | data/5E/5E3I-HIS/5E3I-HIS_ligand.pdbqt | data/5E/5E3I-HIS/5E3I-HIS_target.pdbqt | data/5E/5E3I-HIS/5E3I-HIS_decoys.pdbqt | data/5E/5E3I-HIS/5E3I-HIS_decoy_scores.csv |
5E2K-BX4 | data/5E/5E2K-BX4/5E2K-BX4_ligand.pdbqt | data/5E/5E2K-BX4/5E2K-BX4_target.pdbqt | data/5E/5E2K-BX4/5E2K-BX4_decoys.pdbqt | data/5E/5E2K-BX4/5E2K-BX4_decoy_scores.csv |
5EC0-ADP | data/5E/5EC0-ADP/5EC0-ADP_ligand.pdbqt | data/5E/5EC0-ADP/5EC0-ADP_target.pdbqt | data/5E/5EC0-ADP/5EC0-ADP_decoys.pdbqt | data/5E/5EC0-ADP/5EC0-ADP_decoy_scores.csv |
5ECK-JAA | data/5E/5ECK-JAA/5ECK-JAA_ligand.pdbqt | data/5E/5ECK-JAA/5ECK-JAA_target.pdbqt | data/5E/5ECK-JAA/5ECK-JAA_decoys.pdbqt | data/5E/5ECK-JAA/5ECK-JAA_decoy_scores.csv |
5EWH-5SG | data/5E/5EWH-5SG/5EWH-5SG_ligand.pdbqt | data/5E/5EWH-5SG/5EWH-5SG_target.pdbqt | data/5E/5EWH-5SG/5EWH-5SG_decoys.pdbqt | data/5E/5EWH-5SG/5EWH-5SG_decoy_scores.csv |
5E1S-5JA | data/5E/5E1S-5JA/5E1S-5JA_ligand.pdbqt | data/5E/5E1S-5JA/5E1S-5JA_target.pdbqt | data/5E/5E1S-5JA/5E1S-5JA_decoys.pdbqt | data/5E/5E1S-5JA/5E1S-5JA_decoy_scores.csv |
5ENG-5QN | data/5E/5ENG-5QN/5ENG-5QN_ligand.pdbqt | data/5E/5ENG-5QN/5ENG-5QN_target.pdbqt | data/5E/5ENG-5QN/5ENG-5QN_decoys.pdbqt | data/5E/5ENG-5QN/5ENG-5QN_decoy_scores.csv |
5E1G-T8G | data/5E/5E1G-T8G/5E1G-T8G_ligand.pdbqt | data/5E/5E1G-T8G/5E1G-T8G_target.pdbqt | data/5E/5E1G-T8G/5E1G-T8G_decoys.pdbqt | data/5E/5E1G-T8G/5E1G-T8G_decoy_scores.csv |
5E0W-5KE | data/5E/5E0W-5KE/5E0W-5KE_ligand.pdbqt | data/5E/5E0W-5KE/5E0W-5KE_target.pdbqt | data/5E/5E0W-5KE/5E0W-5KE_decoys.pdbqt | data/5E/5E0W-5KE/5E0W-5KE_decoy_scores.csv |
5E8F-GER | data/5E/5E8F-GER/5E8F-GER_ligand.pdbqt | data/5E/5E8F-GER/5E8F-GER_target.pdbqt | data/5E/5E8F-GER/5E8F-GER_decoys.pdbqt | data/5E/5E8F-GER/5E8F-GER_decoy_scores.csv |
5EEK-TSN | data/5E/5EEK-TSN/5EEK-TSN_ligand.pdbqt | data/5E/5EEK-TSN/5EEK-TSN_target.pdbqt | data/5E/5EEK-TSN/5EEK-TSN_decoys.pdbqt | data/5E/5EEK-TSN/5EEK-TSN_decoy_scores.csv |
5ENR-MBX | data/5E/5ENR-MBX/5ENR-MBX_ligand.pdbqt | data/5E/5ENR-MBX/5ENR-MBX_target.pdbqt | data/5E/5ENR-MBX/5ENR-MBX_decoys.pdbqt | data/5E/5ENR-MBX/5ENR-MBX_decoy_scores.csv |
5E95-GDP | data/5E/5E95-GDP/5E95-GDP_ligand.pdbqt | data/5E/5E95-GDP/5E95-GDP_target.pdbqt | data/5E/5E95-GDP/5E95-GDP_decoys.pdbqt | data/5E/5E95-GDP/5E95-GDP_decoy_scores.csv |
5ETJ-IM5 | data/5E/5ETJ-IM5/5ETJ-IM5_ligand.pdbqt | data/5E/5ETJ-IM5/5ETJ-IM5_target.pdbqt | data/5E/5ETJ-IM5/5ETJ-IM5_decoys.pdbqt | data/5E/5ETJ-IM5/5ETJ-IM5_decoy_scores.csv |
5E5K-017 | data/5E/5E5K-017/5E5K-017_ligand.pdbqt | data/5E/5E5K-017/5E5K-017_target.pdbqt | null | null |
5ECI-ATP | data/5E/5ECI-ATP/5ECI-ATP_ligand.pdbqt | data/5E/5ECI-ATP/5ECI-ATP_target.pdbqt | data/5E/5ECI-ATP/5ECI-ATP_decoys.pdbqt | data/5E/5ECI-ATP/5ECI-ATP_decoy_scores.csv |
5EGU-5NQ | data/5E/5EGU-5NQ/5EGU-5NQ_ligand.pdbqt | data/5E/5EGU-5NQ/5EGU-5NQ_target.pdbqt | data/5E/5EGU-5NQ/5EGU-5NQ_decoys.pdbqt | data/5E/5EGU-5NQ/5EGU-5NQ_decoy_scores.csv |
5ETL-ATP | data/5E/5ETL-ATP/5ETL-ATP_ligand.pdbqt | data/5E/5ETL-ATP/5ETL-ATP_target.pdbqt | data/5E/5ETL-ATP/5ETL-ATP_decoys.pdbqt | data/5E/5ETL-ATP/5ETL-ATP_decoy_scores.csv |
5EY0-GTP | data/5E/5EY0-GTP/5EY0-GTP_ligand.pdbqt | data/5E/5EY0-GTP/5EY0-GTP_target.pdbqt | data/5E/5EY0-GTP/5EY0-GTP_decoys.pdbqt | data/5E/5EY0-GTP/5EY0-GTP_decoy_scores.csv |
5E83-5L7 | data/5E/5E83-5L7/5E83-5L7_ligand.pdbqt | data/5E/5E83-5L7/5E83-5L7_target.pdbqt | data/5E/5E83-5L7/5E83-5L7_decoys.pdbqt | data/5E/5E83-5L7/5E83-5L7_decoy_scores.csv |
5E7D-5KL | data/5E/5E7D-5KL/5E7D-5KL_ligand.pdbqt | data/5E/5E7D-5KL/5E7D-5KL_target.pdbqt | data/5E/5E7D-5KL/5E7D-5KL_decoys.pdbqt | data/5E/5E7D-5KL/5E7D-5KL_decoy_scores.csv |
5E1I-6B8 | data/5E/5E1I-6B8/5E1I-6B8_ligand.pdbqt | data/5E/5E1I-6B8/5E1I-6B8_target.pdbqt | data/5E/5E1I-6B8/5E1I-6B8_decoys.pdbqt | data/5E/5E1I-6B8/5E1I-6B8_decoy_scores.csv |
5E3R-NPI | data/5E/5E3R-NPI/5E3R-NPI_ligand.pdbqt | data/5E/5E3R-NPI/5E3R-NPI_target.pdbqt | data/5E/5E3R-NPI/5E3R-NPI_decoys.pdbqt | data/5E/5E3R-NPI/5E3R-NPI_decoy_scores.csv |
5EC8-5LP | data/5E/5EC8-5LP/5EC8-5LP_ligand.pdbqt | data/5E/5EC8-5LP/5EC8-5LP_target.pdbqt | data/5E/5EC8-5LP/5EC8-5LP_decoys.pdbqt | data/5E/5EC8-5LP/5EC8-5LP_decoy_scores.csv |
5EAM-5MN | data/5E/5EAM-5MN/5EAM-5MN_ligand.pdbqt | data/5E/5EAM-5MN/5EAM-5MN_target.pdbqt | data/5E/5EAM-5MN/5EAM-5MN_decoys.pdbqt | data/5E/5EAM-5MN/5EAM-5MN_decoy_scores.csv |
5ET8-F6P | data/5E/5ET8-F6P/5ET8-F6P_ligand.pdbqt | data/5E/5ET8-F6P/5ET8-F6P_target.pdbqt | data/5E/5ET8-F6P/5ET8-F6P_decoys.pdbqt | data/5E/5ET8-F6P/5ET8-F6P_decoy_scores.csv |
5EFK-MCM | data/5E/5EFK-MCM/5EFK-MCM_ligand.pdbqt | data/5E/5EFK-MCM/5EFK-MCM_target.pdbqt | data/5E/5EFK-MCM/5EFK-MCM_decoys.pdbqt | data/5E/5EFK-MCM/5EFK-MCM_decoy_scores.csv |
5ENL-2PG | data/5E/5ENL-2PG/5ENL-2PG_ligand.pdbqt | data/5E/5ENL-2PG/5ENL-2PG_target.pdbqt | data/5E/5ENL-2PG/5ENL-2PG_decoys.pdbqt | data/5E/5ENL-2PG/5ENL-2PG_decoy_scores.csv |
5E7Z-DTR | data/5E/5E7Z-DTR/5E7Z-DTR_ligand.pdbqt | data/5E/5E7Z-DTR/5E7Z-DTR_target.pdbqt | data/5E/5E7Z-DTR/5E7Z-DTR_decoys.pdbqt | data/5E/5E7Z-DTR/5E7Z-DTR_decoy_scores.csv |
5E2N-V14 | data/5E/5E2N-V14/5E2N-V14_ligand.pdbqt | data/5E/5E2N-V14/5E2N-V14_target.pdbqt | data/5E/5E2N-V14/5E2N-V14_decoys.pdbqt | data/5E/5E2N-V14/5E2N-V14_decoy_scores.csv |
5E9Q-SAM | data/5E/5E9Q-SAM/5E9Q-SAM_ligand.pdbqt | data/5E/5E9Q-SAM/5E9Q-SAM_target.pdbqt | data/5E/5E9Q-SAM/5E9Q-SAM_decoys.pdbqt | data/5E/5E9Q-SAM/5E9Q-SAM_decoy_scores.csv |
5EVK-3C7 | data/5E/5EVK-3C7/5EVK-3C7_ligand.pdbqt | data/5E/5EVK-3C7/5EVK-3C7_target.pdbqt | data/5E/5EVK-3C7/5EVK-3C7_decoys.pdbqt | data/5E/5EVK-3C7/5EVK-3C7_decoy_scores.csv |
5E23-L32 | data/5E/5E23-L32/5E23-L32_ligand.pdbqt | data/5E/5E23-L32/5E23-L32_target.pdbqt | data/5E/5E23-L32/5E23-L32_decoys.pdbqt | data/5E/5E23-L32/5E23-L32_decoy_scores.csv |
5EXA-5SO | data/5E/5EXA-5SO/5EXA-5SO_ligand.pdbqt | data/5E/5EXA-5SO/5EXA-5SO_target.pdbqt | data/5E/5EXA-5SO/5EXA-5SO_decoys.pdbqt | data/5E/5EXA-5SO/5EXA-5SO_decoy_scores.csv |
5ENH-5QB | data/5E/5ENH-5QB/5ENH-5QB_ligand.pdbqt | data/5E/5ENH-5QB/5ENH-5QB_target.pdbqt | data/5E/5ENH-5QB/5ENH-5QB_decoys.pdbqt | data/5E/5ENH-5QB/5ENH-5QB_decoy_scores.csv |
5EC4-5LQ | data/5E/5EC4-5LQ/5EC4-5LQ_ligand.pdbqt | data/5E/5EC4-5LQ/5EC4-5LQ_target.pdbqt | data/5E/5EC4-5LQ/5EC4-5LQ_decoys.pdbqt | data/5E/5EC4-5LQ/5EC4-5LQ_decoy_scores.csv |
5EZY-GTP | data/5E/5EZY-GTP/5EZY-GTP_ligand.pdbqt | data/5E/5EZY-GTP/5EZY-GTP_target.pdbqt | data/5E/5EZY-GTP/5EZY-GTP_decoys.pdbqt | data/5E/5EZY-GTP/5EZY-GTP_decoy_scores.csv |
5EH5-XCZ | data/5E/5EH5-XCZ/5EH5-XCZ_ligand.pdbqt | data/5E/5EH5-XCZ/5EH5-XCZ_target.pdbqt | data/5E/5EH5-XCZ/5EH5-XCZ_decoys.pdbqt | data/5E/5EH5-XCZ/5EH5-XCZ_decoy_scores.csv |
5E28-BC5 | data/5E/5E28-BC5/5E28-BC5_ligand.pdbqt | data/5E/5E28-BC5/5E28-BC5_target.pdbqt | data/5E/5E28-BC5/5E28-BC5_decoys.pdbqt | data/5E/5E28-BC5/5E28-BC5_decoy_scores.csv |
5E3F-THP | data/5E/5E3F-THP/5E3F-THP_ligand.pdbqt | data/5E/5E3F-THP/5E3F-THP_target.pdbqt | data/5E/5E3F-THP/5E3F-THP_decoys.pdbqt | data/5E/5E3F-THP/5E3F-THP_decoy_scores.csv |
5ECP-JAA | data/5E/5ECP-JAA/5ECP-JAA_ligand.pdbqt | data/5E/5ECP-JAA/5ECP-JAA_target.pdbqt | data/5E/5ECP-JAA/5ECP-JAA_decoys.pdbqt | data/5E/5ECP-JAA/5ECP-JAA_decoy_scores.csv |
5EE7-OLA | data/5E/5EE7-OLA/5EE7-OLA_ligand.pdbqt | data/5E/5EE7-OLA/5EE7-OLA_target.pdbqt | data/5E/5EE7-OLA/5EE7-OLA_decoys.pdbqt | data/5E/5EE7-OLA/5EE7-OLA_decoy_scores.csv |
5EWD-5SH | data/5E/5EWD-5SH/5EWD-5SH_ligand.pdbqt | data/5E/5EWD-5SH/5EWD-5SH_target.pdbqt | data/5E/5EWD-5SH/5EWD-5SH_decoys.pdbqt | data/5E/5EWD-5SH/5EWD-5SH_decoy_scores.csv |
5EWC-5SJ | data/5E/5EWC-5SJ/5EWC-5SJ_ligand.pdbqt | data/5E/5EWC-5SJ/5EWC-5SJ_target.pdbqt | data/5E/5EWC-5SJ/5EWC-5SJ_decoys.pdbqt | data/5E/5EWC-5SJ/5EWC-5SJ_decoy_scores.csv |
5EIW-SAM | data/5E/5EIW-SAM/5EIW-SAM_ligand.pdbqt | data/5E/5EIW-SAM/5EIW-SAM_target.pdbqt | data/5E/5EIW-SAM/5EIW-SAM_decoys.pdbqt | data/5E/5EIW-SAM/5EIW-SAM_decoy_scores.csv |
5ETK-APC | data/5E/5ETK-APC/5ETK-APC_ligand.pdbqt | data/5E/5ETK-APC/5ETK-APC_target.pdbqt | data/5E/5ETK-APC/5ETK-APC_decoys.pdbqt | data/5E/5ETK-APC/5ETK-APC_decoy_scores.csv |
5ERT-ADP | data/5E/5ERT-ADP/5ERT-ADP_ligand.pdbqt | data/5E/5ERT-ADP/5ERT-ADP_target.pdbqt | data/5E/5ERT-ADP/5ERT-ADP_decoys.pdbqt | data/5E/5ERT-ADP/5ERT-ADP_decoy_scores.csv |
5ECN-ATP | data/5E/5ECN-ATP/5ECN-ATP_ligand.pdbqt | data/5E/5ECN-ATP/5ECN-ATP_target.pdbqt | data/5E/5ECN-ATP/5ECN-ATP_decoys.pdbqt | data/5E/5ECN-ATP/5ECN-ATP_decoy_scores.csv |
5E9E-ANP | data/5E/5E9E-ANP/5E9E-ANP_ligand.pdbqt | data/5E/5E9E-ANP/5E9E-ANP_target.pdbqt | data/5E/5E9E-ANP/5E9E-ANP_decoys.pdbqt | data/5E/5E9E-ANP/5E9E-ANP_decoy_scores.csv |
5ELN-LYS | data/5E/5ELN-LYS/5ELN-LYS_ligand.pdbqt | data/5E/5ELN-LYS/5ELN-LYS_target.pdbqt | data/5E/5ELN-LYS/5ELN-LYS_decoys.pdbqt | data/5E/5ELN-LYS/5ELN-LYS_decoy_scores.csv |
5ESS-TOG | data/5E/5ESS-TOG/5ESS-TOG_ligand.pdbqt | data/5E/5ESS-TOG/5ESS-TOG_target.pdbqt | data/5E/5ESS-TOG/5ESS-TOG_decoys.pdbqt | data/5E/5ESS-TOG/5ESS-TOG_decoy_scores.csv |
5EPH-ID1 | data/5E/5EPH-ID1/5EPH-ID1_ligand.pdbqt | data/5E/5EPH-ID1/5EPH-ID1_target.pdbqt | data/5E/5EPH-ID1/5EPH-ID1_decoys.pdbqt | data/5E/5EPH-ID1/5EPH-ID1_decoy_scores.csv |
5EU1-5SW | data/5E/5EU1-5SW/5EU1-5SW_ligand.pdbqt | data/5E/5EU1-5SW/5EU1-5SW_target.pdbqt | data/5E/5EU1-5SW/5EU1-5SW_decoys.pdbqt | data/5E/5EU1-5SW/5EU1-5SW_decoy_scores.csv |
5EVA-5S9 | data/5E/5EVA-5S9/5EVA-5S9_ligand.pdbqt | data/5E/5EVA-5S9/5EVA-5S9_target.pdbqt | data/5E/5EVA-5S9/5EVA-5S9_decoys.pdbqt | data/5E/5EVA-5S9/5EVA-5S9_decoy_scores.csv |
5ETP-APC | data/5E/5ETP-APC/5ETP-APC_ligand.pdbqt | data/5E/5ETP-APC/5ETP-APC_target.pdbqt | data/5E/5ETP-APC/5ETP-APC_decoys.pdbqt | data/5E/5ETP-APC/5ETP-APC_decoy_scores.csv |
5EBL-F09 | data/5E/5EBL-F09/5EBL-F09_ligand.pdbqt | data/5E/5EBL-F09/5EBL-F09_target.pdbqt | data/5E/5EBL-F09/5EBL-F09_decoys.pdbqt | data/5E/5EBL-F09/5EBL-F09_decoy_scores.csv |
5E2S-5CX | data/5E/5E2S-5CX/5E2S-5CX_ligand.pdbqt | data/5E/5E2S-5CX/5E2S-5CX_target.pdbqt | data/5E/5E2S-5CX/5E2S-5CX_decoys.pdbqt | data/5E/5E2S-5CX/5E2S-5CX_decoy_scores.csv |
5EDB-5M8 | data/5E/5EDB-5M8/5EDB-5M8_ligand.pdbqt | data/5E/5EDB-5M8/5EDB-5M8_target.pdbqt | data/5E/5EDB-5M8/5EDB-5M8_decoys.pdbqt | data/5E/5EDB-5M8/5EDB-5M8_decoy_scores.csv |
5E15-5KA | data/5E/5E15-5KA/5E15-5KA_ligand.pdbqt | data/5E/5E15-5KA/5E15-5KA_target.pdbqt | data/5E/5E15-5KA/5E15-5KA_decoys.pdbqt | data/5E/5E15-5KA/5E15-5KA_decoy_scores.csv |
5EL9-5DL | data/5E/5EL9-5DL/5EL9-5DL_ligand.pdbqt | data/5E/5EL9-5DL/5EL9-5DL_target.pdbqt | data/5E/5EL9-5DL/5EL9-5DL_decoys.pdbqt | data/5E/5EL9-5DL/5EL9-5DL_decoy_scores.csv |
5EAL-5ML | data/5E/5EAL-5ML/5EAL-5ML_ligand.pdbqt | data/5E/5EAL-5ML/5EAL-5ML_target.pdbqt | data/5E/5EAL-5ML/5EAL-5ML_decoys.pdbqt | data/5E/5EAL-5ML/5EAL-5ML_decoy_scores.csv |
5EFQ-ADP | data/5E/5EFQ-ADP/5EFQ-ADP_ligand.pdbqt | data/5E/5EFQ-ADP/5EFQ-ADP_target.pdbqt | null | null |
5EOY-ADP | data/5E/5EOY-ADP/5EOY-ADP_ligand.pdbqt | data/5E/5EOY-ADP/5EOY-ADP_target.pdbqt | data/5E/5EOY-ADP/5EOY-ADP_decoys.pdbqt | data/5E/5EOY-ADP/5EOY-ADP_decoy_scores.csv |
5EXZ-ATP | data/5E/5EXZ-ATP/5EXZ-ATP_ligand.pdbqt | data/5E/5EXZ-ATP/5EXZ-ATP_target.pdbqt | data/5E/5EXZ-ATP/5EXZ-ATP_decoys.pdbqt | data/5E/5EXZ-ATP/5EXZ-ATP_decoy_scores.csv |
5E7J-AMP | data/5E/5E7J-AMP/5E7J-AMP_ligand.pdbqt | data/5E/5E7J-AMP/5E7J-AMP_target.pdbqt | data/5E/5E7J-AMP/5E7J-AMP_decoys.pdbqt | data/5E/5E7J-AMP/5E7J-AMP_decoy_scores.csv |
5ENI-5QA | data/5E/5ENI-5QA/5ENI-5QA_ligand.pdbqt | data/5E/5ENI-5QA/5ENI-5QA_target.pdbqt | data/5E/5ENI-5QA/5ENI-5QA_decoys.pdbqt | data/5E/5ENI-5QA/5ENI-5QA_decoy_scores.csv |
5EDH-5MF | data/5E/5EDH-5MF/5EDH-5MF_ligand.pdbqt | data/5E/5EDH-5MF/5EDH-5MF_target.pdbqt | data/5E/5EDH-5MF/5EDH-5MF_decoys.pdbqt | data/5E/5EDH-5MF/5EDH-5MF_decoy_scores.csv |
5ENT-MIY | data/5E/5ENT-MIY/5ENT-MIY_ligand.pdbqt | data/5E/5ENT-MIY/5ENT-MIY_target.pdbqt | data/5E/5ENT-MIY/5ENT-MIY_decoys.pdbqt | data/5E/5ENT-MIY/5ENT-MIY_decoy_scores.csv |
5EAP-5MO | data/5E/5EAP-5MO/5EAP-5MO_ligand.pdbqt | data/5E/5EAP-5MO/5EAP-5MO_target.pdbqt | data/5E/5EAP-5MO/5EAP-5MO_decoys.pdbqt | data/5E/5EAP-5MO/5EAP-5MO_decoy_scores.csv |
5EWW-5SK | data/5E/5EWW-5SK/5EWW-5SK_ligand.pdbqt | data/5E/5EWW-5SK/5EWW-5SK_target.pdbqt | data/5E/5EWW-5SK/5EWW-5SK_decoys.pdbqt | data/5E/5EWW-5SK/5EWW-5SK_decoy_scores.csv |
5EZH-841 | data/5E/5EZH-841/5EZH-841_ligand.pdbqt | data/5E/5EZH-841/5EZH-841_target.pdbqt | data/5E/5EZH-841/5EZH-841_decoys.pdbqt | data/5E/5EZH-841/5EZH-841_decoy_scores.csv |
5ECH-JAA | data/5E/5ECH-JAA/5ECH-JAA_ligand.pdbqt | data/5E/5ECH-JAA/5ECH-JAA_target.pdbqt | data/5E/5ECH-JAA/5ECH-JAA_decoys.pdbqt | data/5E/5ECH-JAA/5ECH-JAA_decoy_scores.csv |
5E0I-5J6 | data/5E/5E0I-5J6/5E0I-5J6_ligand.pdbqt | data/5E/5E0I-5J6/5E0I-5J6_target.pdbqt | data/5E/5E0I-5J6/5E0I-5J6_decoys.pdbqt | data/5E/5E0I-5J6/5E0I-5J6_decoy_scores.csv |
5EC8-SAM | data/5E/5EC8-SAM/5EC8-SAM_ligand.pdbqt | data/5E/5EC8-SAM/5EC8-SAM_target.pdbqt | data/5E/5EC8-SAM/5EC8-SAM_decoys.pdbqt | data/5E/5EC8-SAM/5EC8-SAM_decoy_scores.csv |
5EKL-THP | data/5E/5EKL-THP/5EKL-THP_ligand.pdbqt | data/5E/5EKL-THP/5EKL-THP_target.pdbqt | data/5E/5EKL-THP/5EKL-THP_decoys.pdbqt | data/5E/5EKL-THP/5EKL-THP_decoy_scores.csv |
5EYF-GLU | data/5E/5EYF-GLU/5EYF-GLU_ligand.pdbqt | data/5E/5EYF-GLU/5EYF-GLU_target.pdbqt | data/5E/5EYF-GLU/5EYF-GLU_decoys.pdbqt | data/5E/5EYF-GLU/5EYF-GLU_decoy_scores.csv |
5EHZ-P6G | data/5E/5EHZ-P6G/5EHZ-P6G_ligand.pdbqt | data/5E/5EHZ-P6G/5EHZ-P6G_target.pdbqt | data/5E/5EHZ-P6G/5EHZ-P6G_decoys.pdbqt | data/5E/5EHZ-P6G/5EHZ-P6G_decoy_scores.csv |
5EW8-5SF | data/5E/5EW8-5SF/5EW8-5SF_ligand.pdbqt | data/5E/5EW8-5SF/5EW8-5SF_target.pdbqt | data/5E/5EW8-5SF/5EW8-5SF_decoys.pdbqt | data/5E/5EW8-5SF/5EW8-5SF_decoy_scores.csv |
5EIF-4M0 | data/5E/5EIF-4M0/5EIF-4M0_ligand.pdbqt | data/5E/5EIF-4M0/5EIF-4M0_target.pdbqt | data/5E/5EIF-4M0/5EIF-4M0_decoys.pdbqt | data/5E/5EIF-4M0/5EIF-4M0_decoy_scores.csv |
5EEH-SAH | data/5E/5EEH-SAH/5EEH-SAH_ligand.pdbqt | data/5E/5EEH-SAH/5EEH-SAH_target.pdbqt | data/5E/5EEH-SAH/5EEH-SAH_decoys.pdbqt | data/5E/5EEH-SAH/5EEH-SAH_decoy_scores.csv |
5EH8-5O6 | data/5E/5EH8-5O6/5EH8-5O6_ligand.pdbqt | data/5E/5EH8-5O6/5EH8-5O6_target.pdbqt | data/5E/5EH8-5O6/5EH8-5O6_decoys.pdbqt | data/5E/5EH8-5O6/5EH8-5O6_decoy_scores.csv |
5EAM-BTB | data/5E/5EAM-BTB/5EAM-BTB_ligand.pdbqt | data/5E/5EAM-BTB/5EAM-BTB_target.pdbqt | data/5E/5EAM-BTB/5EAM-BTB_decoys.pdbqt | data/5E/5EAM-BTB/5EAM-BTB_decoy_scores.csv |
5EAE-5L8 | data/5E/5EAE-5L8/5EAE-5L8_ligand.pdbqt | data/5E/5EAE-5L8/5EAE-5L8_target.pdbqt | data/5E/5EAE-5L8/5EAE-5L8_decoys.pdbqt | data/5E/5EAE-5L8/5EAE-5L8_decoy_scores.csv |
5EH7-5O5 | data/5E/5EH7-5O5/5EH7-5O5_ligand.pdbqt | data/5E/5EH7-5O5/5EH7-5O5_target.pdbqt | data/5E/5EH7-5O5/5EH7-5O5_decoys.pdbqt | data/5E/5EH7-5O5/5EH7-5O5_decoy_scores.csv |
5E26-PAU | data/5E/5E26-PAU/5E26-PAU_ligand.pdbqt | data/5E/5E26-PAU/5E26-PAU_target.pdbqt | data/5E/5E26-PAU/5E26-PAU_decoys.pdbqt | data/5E/5E26-PAU/5E26-PAU_decoy_scores.csv |
5EXL-5SS | data/5E/5EXL-5SS/5EXL-5SS_ligand.pdbqt | data/5E/5EXL-5SS/5EXL-5SS_target.pdbqt | data/5E/5EXL-5SS/5EXL-5SS_decoys.pdbqt | data/5E/5EXL-5SS/5EXL-5SS_decoy_scores.csv |
5ETO-APC | data/5E/5ETO-APC/5ETO-APC_ligand.pdbqt | data/5E/5ETO-APC/5ETO-APC_target.pdbqt | data/5E/5ETO-APC/5ETO-APC_decoys.pdbqt | data/5E/5ETO-APC/5ETO-APC_decoy_scores.csv |
5E16-PCG | data/5E/5E16-PCG/5E16-PCG_ligand.pdbqt | data/5E/5E16-PCG/5E16-PCG_target.pdbqt | data/5E/5E16-PCG/5E16-PCG_decoys.pdbqt | data/5E/5E16-PCG/5E16-PCG_decoy_scores.csv |
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