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 ⌀ |
|---|---|---|---|---|
6E6C-GNP | data/6E/6E6C-GNP/6E6C-GNP_ligand.pdbqt | data/6E/6E6C-GNP/6E6C-GNP_target.pdbqt | data/6E/6E6C-GNP/6E6C-GNP_decoys.pdbqt | data/6E/6E6C-GNP/6E6C-GNP_decoy_scores.csv |
6EZB-FMN | data/6E/6EZB-FMN/6EZB-FMN_ligand.pdbqt | data/6E/6EZB-FMN/6EZB-FMN_target.pdbqt | data/6E/6EZB-FMN/6EZB-FMN_decoys.pdbqt | data/6E/6EZB-FMN/6EZB-FMN_decoy_scores.csv |
6ES0-BW8 | data/6E/6ES0-BW8/6ES0-BW8_ligand.pdbqt | data/6E/6ES0-BW8/6ES0-BW8_target.pdbqt | data/6E/6ES0-BW8/6ES0-BW8_decoys.pdbqt | data/6E/6ES0-BW8/6ES0-BW8_decoy_scores.csv |
6E12-OLA | data/6E/6E12-OLA/6E12-OLA_ligand.pdbqt | data/6E/6E12-OLA/6E12-OLA_target.pdbqt | data/6E/6E12-OLA/6E12-OLA_decoys.pdbqt | data/6E/6E12-OLA/6E12-OLA_decoy_scores.csv |
6EDG-P34 | data/6E/6EDG-P34/6EDG-P34_ligand.pdbqt | data/6E/6EDG-P34/6EDG-P34_target.pdbqt | data/6E/6EDG-P34/6EDG-P34_decoys.pdbqt | data/6E/6EDG-P34/6EDG-P34_decoy_scores.csv |
6EX1-N19 | data/6E/6EX1-N19/6EX1-N19_ligand.pdbqt | data/6E/6EX1-N19/6EX1-N19_target.pdbqt | data/6E/6EX1-N19/6EX1-N19_decoys.pdbqt | data/6E/6EX1-N19/6EX1-N19_decoy_scores.csv |
6E5T-HVJ | data/6E/6E5T-HVJ/6E5T-HVJ_ligand.pdbqt | data/6E/6E5T-HVJ/6E5T-HVJ_target.pdbqt | data/6E/6E5T-HVJ/6E5T-HVJ_decoys.pdbqt | data/6E/6E5T-HVJ/6E5T-HVJ_decoy_scores.csv |
6EAC-ANP | data/6E/6EAC-ANP/6EAC-ANP_ligand.pdbqt | data/6E/6EAC-ANP/6EAC-ANP_target.pdbqt | data/6E/6EAC-ANP/6EAC-ANP_decoys.pdbqt | data/6E/6EAC-ANP/6EAC-ANP_decoy_scores.csv |
6EOP-F15 | data/6E/6EOP-F15/6EOP-F15_ligand.pdbqt | data/6E/6EOP-F15/6EOP-F15_target.pdbqt | data/6E/6EOP-F15/6EOP-F15_decoys.pdbqt | data/6E/6EOP-F15/6EOP-F15_decoy_scores.csv |
6EFV-FMN | data/6E/6EFV-FMN/6EFV-FMN_ligand.pdbqt | data/6E/6EFV-FMN/6EFV-FMN_target.pdbqt | data/6E/6EFV-FMN/6EFV-FMN_decoys.pdbqt | data/6E/6EFV-FMN/6EFV-FMN_decoy_scores.csv |
6E13-HKS | data/6E/6E13-HKS/6E13-HKS_ligand.pdbqt | data/6E/6E13-HKS/6E13-HKS_target.pdbqt | data/6E/6E13-HKS/6E13-HKS_decoys.pdbqt | data/6E/6E13-HKS/6E13-HKS_decoy_scores.csv |
6EZX-C7Q | data/6E/6EZX-C7Q/6EZX-C7Q_ligand.pdbqt | data/6E/6EZX-C7Q/6EZX-C7Q_target.pdbqt | data/6E/6EZX-C7Q/6EZX-C7Q_decoys.pdbqt | data/6E/6EZX-C7Q/6EZX-C7Q_decoy_scores.csv |
6EON-GLA | data/6E/6EON-GLA/6EON-GLA_ligand.pdbqt | data/6E/6EON-GLA/6EON-GLA_target.pdbqt | data/6E/6EON-GLA/6EON-GLA_decoys.pdbqt | data/6E/6EON-GLA/6EON-GLA_decoy_scores.csv |
6E1X-HLG | data/6E/6E1X-HLG/6E1X-HLG_ligand.pdbqt | data/6E/6E1X-HLG/6E1X-HLG_target.pdbqt | data/6E/6E1X-HLG/6E1X-HLG_decoys.pdbqt | data/6E/6E1X-HLG/6E1X-HLG_decoy_scores.csv |
6EVE-4LU | data/6E/6EVE-4LU/6EVE-4LU_ligand.pdbqt | data/6E/6EVE-4LU/6EVE-4LU_target.pdbqt | data/6E/6EVE-4LU/6EVE-4LU_decoys.pdbqt | data/6E/6EVE-4LU/6EVE-4LU_decoy_scores.csv |
6EEJ-J6S | data/6E/6EEJ-J6S/6EEJ-J6S_ligand.pdbqt | data/6E/6EEJ-J6S/6EEJ-J6S_target.pdbqt | data/6E/6EEJ-J6S/6EEJ-J6S_decoys.pdbqt | data/6E/6EEJ-J6S/6EEJ-J6S_decoy_scores.csv |
6EUI-GAL | data/6E/6EUI-GAL/6EUI-GAL_ligand.pdbqt | data/6E/6EUI-GAL/6EUI-GAL_target.pdbqt | data/6E/6EUI-GAL/6EUI-GAL_decoys.pdbqt | data/6E/6EUI-GAL/6EUI-GAL_decoy_scores.csv |
6EQU-BVE | data/6E/6EQU-BVE/6EQU-BVE_ligand.pdbqt | data/6E/6EQU-BVE/6EQU-BVE_target.pdbqt | data/6E/6EQU-BVE/6EQU-BVE_decoys.pdbqt | data/6E/6EQU-BVE/6EQU-BVE_decoy_scores.csv |
6E4L-HRS | data/6E/6E4L-HRS/6E4L-HRS_ligand.pdbqt | data/6E/6E4L-HRS/6E4L-HRS_target.pdbqt | data/6E/6E4L-HRS/6E4L-HRS_decoys.pdbqt | data/6E/6E4L-HRS/6E4L-HRS_decoy_scores.csv |
6ECL-T90 | data/6E/6ECL-T90/6ECL-T90_ligand.pdbqt | data/6E/6ECL-T90/6ECL-T90_target.pdbqt | data/6E/6ECL-T90/6ECL-T90_decoys.pdbqt | data/6E/6ECL-T90/6ECL-T90_decoy_scores.csv |
6EOM-LYS | data/6E/6EOM-LYS/6EOM-LYS_ligand.pdbqt | data/6E/6EOM-LYS/6EOM-LYS_target.pdbqt | data/6E/6EOM-LYS/6EOM-LYS_decoys.pdbqt | data/6E/6EOM-LYS/6EOM-LYS_decoy_scores.csv |
6ET4-FMN | data/6E/6ET4-FMN/6ET4-FMN_ligand.pdbqt | data/6E/6ET4-FMN/6ET4-FMN_target.pdbqt | data/6E/6ET4-FMN/6ET4-FMN_decoys.pdbqt | data/6E/6ET4-FMN/6ET4-FMN_decoy_scores.csv |
6EIJ-B5Z | data/6E/6EIJ-B5Z/6EIJ-B5Z_ligand.pdbqt | data/6E/6EIJ-B5Z/6EIJ-B5Z_target.pdbqt | data/6E/6EIJ-B5Z/6EIJ-B5Z_decoys.pdbqt | data/6E/6EIJ-B5Z/6EIJ-B5Z_decoy_scores.csv |
6EKX-1NP | data/6E/6EKX-1NP/6EKX-1NP_ligand.pdbqt | data/6E/6EKX-1NP/6EKX-1NP_target.pdbqt | data/6E/6EKX-1NP/6EKX-1NP_decoys.pdbqt | data/6E/6EKX-1NP/6EKX-1NP_decoy_scores.csv |
6EWR-PMP | data/6E/6EWR-PMP/6EWR-PMP_ligand.pdbqt | data/6E/6EWR-PMP/6EWR-PMP_target.pdbqt | data/6E/6EWR-PMP/6EWR-PMP_decoys.pdbqt | data/6E/6EWR-PMP/6EWR-PMP_decoy_scores.csv |
6EM7-ADP | data/6E/6EM7-ADP/6EM7-ADP_ligand.pdbqt | data/6E/6EM7-ADP/6EM7-ADP_target.pdbqt | data/6E/6EM7-ADP/6EM7-ADP_decoys.pdbqt | data/6E/6EM7-ADP/6EM7-ADP_decoy_scores.csv |
6EKQ-B0H | data/6E/6EKQ-B0H/6EKQ-B0H_ligand.pdbqt | data/6E/6EKQ-B0H/6EKQ-B0H_target.pdbqt | data/6E/6EKQ-B0H/6EKQ-B0H_decoys.pdbqt | data/6E/6EKQ-B0H/6EKQ-B0H_decoy_scores.csv |
6ECT-SAM | data/6E/6ECT-SAM/6ECT-SAM_ligand.pdbqt | data/6E/6ECT-SAM/6ECT-SAM_target.pdbqt | data/6E/6ECT-SAM/6ECT-SAM_decoys.pdbqt | data/6E/6ECT-SAM/6ECT-SAM_decoy_scores.csv |
6EG5-ACP | data/6E/6EG5-ACP/6EG5-ACP_ligand.pdbqt | data/6E/6EG5-ACP/6EG5-ACP_target.pdbqt | data/6E/6EG5-ACP/6EG5-ACP_decoys.pdbqt | data/6E/6EG5-ACP/6EG5-ACP_decoy_scores.csv |
6EP8-NAD | data/6E/6EP8-NAD/6EP8-NAD_ligand.pdbqt | data/6E/6EP8-NAD/6EP8-NAD_target.pdbqt | data/6E/6EP8-NAD/6EP8-NAD_decoys.pdbqt | data/6E/6EP8-NAD/6EP8-NAD_decoy_scores.csv |
6ERN-ATP | data/6E/6ERN-ATP/6ERN-ATP_ligand.pdbqt | data/6E/6ERN-ATP/6ERN-ATP_target.pdbqt | data/6E/6ERN-ATP/6ERN-ATP_decoys.pdbqt | data/6E/6ERN-ATP/6ERN-ATP_decoy_scores.csv |
6E2Y-ADP | data/6E/6E2Y-ADP/6E2Y-ADP_ligand.pdbqt | data/6E/6E2Y-ADP/6E2Y-ADP_target.pdbqt | data/6E/6E2Y-ADP/6E2Y-ADP_decoys.pdbqt | data/6E/6E2Y-ADP/6E2Y-ADP_decoy_scores.csv |
6ETT-BXH | data/6E/6ETT-BXH/6ETT-BXH_ligand.pdbqt | data/6E/6ETT-BXH/6ETT-BXH_target.pdbqt | data/6E/6ETT-BXH/6ETT-BXH_decoys.pdbqt | data/6E/6ETT-BXH/6ETT-BXH_decoy_scores.csv |
6ECP-21V | data/6E/6ECP-21V/6ECP-21V_ligand.pdbqt | data/6E/6ECP-21V/6ECP-21V_target.pdbqt | data/6E/6ECP-21V/6ECP-21V_decoys.pdbqt | data/6E/6ECP-21V/6ECP-21V_decoy_scores.csv |
6E40-BBJ | data/6E/6E40-BBJ/6E40-BBJ_ligand.pdbqt | data/6E/6E40-BBJ/6E40-BBJ_target.pdbqt | data/6E/6E40-BBJ/6E40-BBJ_decoys.pdbqt | data/6E/6E40-BBJ/6E40-BBJ_decoy_scores.csv |
6E68-HVM | data/6E/6E68-HVM/6E68-HVM_ligand.pdbqt | data/6E/6E68-HVM/6E68-HVM_target.pdbqt | data/6E/6E68-HVM/6E68-HVM_decoys.pdbqt | data/6E/6E68-HVM/6E68-HVM_decoy_scores.csv |
6EKW-NPY | data/6E/6EKW-NPY/6EKW-NPY_ligand.pdbqt | data/6E/6EKW-NPY/6EKW-NPY_target.pdbqt | data/6E/6EKW-NPY/6EKW-NPY_decoys.pdbqt | data/6E/6EKW-NPY/6EKW-NPY_decoy_scores.csv |
6E05-CTP | data/6E/6E05-CTP/6E05-CTP_ligand.pdbqt | data/6E/6E05-CTP/6E05-CTP_target.pdbqt | data/6E/6E05-CTP/6E05-CTP_decoys.pdbqt | data/6E/6E05-CTP/6E05-CTP_decoy_scores.csv |
6EOF-ADP | data/6E/6EOF-ADP/6EOF-ADP_ligand.pdbqt | data/6E/6EOF-ADP/6EOF-ADP_target.pdbqt | data/6E/6EOF-ADP/6EOF-ADP_decoys.pdbqt | data/6E/6EOF-ADP/6EOF-ADP_decoy_scores.csv |
6ESU-6IR | data/6E/6ESU-6IR/6ESU-6IR_ligand.pdbqt | data/6E/6ESU-6IR/6ESU-6IR_target.pdbqt | null | null |
6EBQ-FMN | data/6E/6EBQ-FMN/6EBQ-FMN_ligand.pdbqt | data/6E/6EBQ-FMN/6EBQ-FMN_target.pdbqt | data/6E/6EBQ-FMN/6EBQ-FMN_decoys.pdbqt | data/6E/6EBQ-FMN/6EBQ-FMN_decoy_scores.csv |
6EIS-B6N | data/6E/6EIS-B6N/6EIS-B6N_ligand.pdbqt | data/6E/6EIS-B6N/6EIS-B6N_target.pdbqt | data/6E/6EIS-B6N/6EIS-B6N_decoys.pdbqt | data/6E/6EIS-B6N/6EIS-B6N_decoy_scores.csv |
6EV4-4LU | data/6E/6EV4-4LU/6EV4-4LU_ligand.pdbqt | data/6E/6EV4-4LU/6EV4-4LU_target.pdbqt | data/6E/6EV4-4LU/6EV4-4LU_decoys.pdbqt | data/6E/6EV4-4LU/6EV4-4LU_decoy_scores.csv |
6EZF-C6Z | data/6E/6EZF-C6Z/6EZF-C6Z_ligand.pdbqt | data/6E/6EZF-C6Z/6EZF-C6Z_target.pdbqt | data/6E/6EZF-C6Z/6EZF-C6Z_decoys.pdbqt | data/6E/6EZF-C6Z/6EZF-C6Z_decoy_scores.csv |
6EOL-BKH | data/6E/6EOL-BKH/6EOL-BKH_ligand.pdbqt | data/6E/6EOL-BKH/6EOL-BKH_target.pdbqt | data/6E/6EOL-BKH/6EOL-BKH_decoys.pdbqt | data/6E/6EOL-BKH/6EOL-BKH_decoy_scores.csv |
6EG5-GTP | data/6E/6EG5-GTP/6EG5-GTP_ligand.pdbqt | data/6E/6EG5-GTP/6EG5-GTP_target.pdbqt | data/6E/6EG5-GTP/6EG5-GTP_decoys.pdbqt | data/6E/6EG5-GTP/6EG5-GTP_decoy_scores.csv |
6E70-1FL | data/6E/6E70-1FL/6E70-1FL_ligand.pdbqt | data/6E/6E70-1FL/6E70-1FL_target.pdbqt | data/6E/6E70-1FL/6E70-1FL_decoys.pdbqt | data/6E/6E70-1FL/6E70-1FL_decoy_scores.csv |
6E77-3MI | data/6E/6E77-3MI/6E77-3MI_ligand.pdbqt | data/6E/6E77-3MI/6E77-3MI_target.pdbqt | data/6E/6E77-3MI/6E77-3MI_decoys.pdbqt | data/6E/6E77-3MI/6E77-3MI_decoy_scores.csv |
6EE4-J4S | data/6E/6EE4-J4S/6EE4-J4S_ligand.pdbqt | data/6E/6EE4-J4S/6EE4-J4S_target.pdbqt | data/6E/6EE4-J4S/6EE4-J4S_decoys.pdbqt | data/6E/6EE4-J4S/6EE4-J4S_decoy_scores.csv |
6ECV-SAH | data/6E/6ECV-SAH/6ECV-SAH_ligand.pdbqt | data/6E/6ECV-SAH/6ECV-SAH_target.pdbqt | data/6E/6ECV-SAH/6ECV-SAH_decoys.pdbqt | data/6E/6ECV-SAH/6ECV-SAH_decoy_scores.csv |
6EU5-BXN | data/6E/6EU5-BXN/6EU5-BXN_ligand.pdbqt | data/6E/6EU5-BXN/6EU5-BXN_target.pdbqt | data/6E/6EU5-BXN/6EU5-BXN_decoys.pdbqt | data/6E/6EU5-BXN/6EU5-BXN_decoy_scores.csv |
6EUM-BY5 | data/6E/6EUM-BY5/6EUM-BY5_ligand.pdbqt | data/6E/6EUM-BY5/6EUM-BY5_target.pdbqt | data/6E/6EUM-BY5/6EUM-BY5_decoys.pdbqt | data/6E/6EUM-BY5/6EUM-BY5_decoy_scores.csv |
6ES8-IHP | data/6E/6ES8-IHP/6ES8-IHP_ligand.pdbqt | data/6E/6ES8-IHP/6ES8-IHP_target.pdbqt | data/6E/6ES8-IHP/6ES8-IHP_decoys.pdbqt | data/6E/6ES8-IHP/6ES8-IHP_decoy_scores.csv |
6EHD-C8E | data/6E/6EHD-C8E/6EHD-C8E_ligand.pdbqt | data/6E/6EHD-C8E/6EHD-C8E_target.pdbqt | data/6E/6EHD-C8E/6EHD-C8E_decoys.pdbqt | data/6E/6EHD-C8E/6EHD-C8E_decoy_scores.csv |
6EXK-C2Q | data/6E/6EXK-C2Q/6EXK-C2Q_ligand.pdbqt | data/6E/6EXK-C2Q/6EXK-C2Q_target.pdbqt | data/6E/6EXK-C2Q/6EXK-C2Q_decoys.pdbqt | data/6E/6EXK-C2Q/6EXK-C2Q_decoy_scores.csv |
6EPT-BQQ | data/6E/6EPT-BQQ/6EPT-BQQ_ligand.pdbqt | data/6E/6EPT-BQQ/6EPT-BQQ_target.pdbqt | data/6E/6EPT-BQQ/6EPT-BQQ_decoys.pdbqt | data/6E/6EPT-BQQ/6EPT-BQQ_decoy_scores.csv |
6EPW-BQ8 | data/6E/6EPW-BQ8/6EPW-BQ8_ligand.pdbqt | data/6E/6EPW-BQ8/6EPW-BQ8_target.pdbqt | data/6E/6EPW-BQ8/6EPW-BQ8_decoys.pdbqt | data/6E/6EPW-BQ8/6EPW-BQ8_decoy_scores.csv |
6EL7-B9T | data/6E/6EL7-B9T/6EL7-B9T_ligand.pdbqt | data/6E/6EL7-B9T/6EL7-B9T_target.pdbqt | data/6E/6EL7-B9T/6EL7-B9T_decoys.pdbqt | data/6E/6EL7-B9T/6EL7-B9T_decoy_scores.csv |
6E4C-HRJ | data/6E/6E4C-HRJ/6E4C-HRJ_ligand.pdbqt | data/6E/6E4C-HRJ/6E4C-HRJ_target.pdbqt | data/6E/6E4C-HRJ/6E4C-HRJ_decoys.pdbqt | data/6E/6E4C-HRJ/6E4C-HRJ_decoy_scores.csv |
6EZU-CMP | data/6E/6EZU-CMP/6EZU-CMP_ligand.pdbqt | data/6E/6EZU-CMP/6EZU-CMP_target.pdbqt | data/6E/6EZU-CMP/6EZU-CMP_decoys.pdbqt | data/6E/6EZU-CMP/6EZU-CMP_decoy_scores.csv |
6E0N-GTP | data/6E/6E0N-GTP/6E0N-GTP_ligand.pdbqt | data/6E/6E0N-GTP/6E0N-GTP_target.pdbqt | data/6E/6E0N-GTP/6E0N-GTP_decoys.pdbqt | data/6E/6E0N-GTP/6E0N-GTP_decoy_scores.csv |
6E90-NAD | data/6E/6E90-NAD/6E90-NAD_ligand.pdbqt | data/6E/6E90-NAD/6E90-NAD_target.pdbqt | data/6E/6E90-NAD/6E90-NAD_decoys.pdbqt | data/6E/6E90-NAD/6E90-NAD_decoy_scores.csv |
6EYI-C4Z | data/6E/6EYI-C4Z/6EYI-C4Z_ligand.pdbqt | data/6E/6EYI-C4Z/6EYI-C4Z_target.pdbqt | data/6E/6EYI-C4Z/6EYI-C4Z_decoys.pdbqt | data/6E/6EYI-C4Z/6EYI-C4Z_decoy_scores.csv |
6E5W-HVD | data/6E/6E5W-HVD/6E5W-HVD_ligand.pdbqt | data/6E/6E5W-HVD/6E5W-HVD_target.pdbqt | data/6E/6E5W-HVD/6E5W-HVD_decoys.pdbqt | data/6E/6E5W-HVD/6E5W-HVD_decoy_scores.csv |
6EMM-NAD | data/6E/6EMM-NAD/6EMM-NAD_ligand.pdbqt | data/6E/6EMM-NAD/6EMM-NAD_target.pdbqt | data/6E/6EMM-NAD/6EMM-NAD_decoys.pdbqt | data/6E/6EMM-NAD/6EMM-NAD_decoy_scores.csv |
6EZY-GS8 | data/6E/6EZY-GS8/6EZY-GS8_ligand.pdbqt | data/6E/6EZY-GS8/6EZY-GS8_target.pdbqt | data/6E/6EZY-GS8/6EZY-GS8_decoys.pdbqt | data/6E/6EZY-GS8/6EZY-GS8_decoy_scores.csv |
721P-GNP | data/72/721P-GNP/721P-GNP_ligand.pdbqt | data/72/721P-GNP/721P-GNP_target.pdbqt | data/72/721P-GNP/721P-GNP_decoys.pdbqt | data/72/721P-GNP/721P-GNP_decoy_scores.csv |
2CK3-ADP | data/2C/2CK3-ADP/2CK3-ADP_ligand.pdbqt | data/2C/2CK3-ADP/2CK3-ADP_target.pdbqt | data/2C/2CK3-ADP/2CK3-ADP_decoys.pdbqt | data/2C/2CK3-ADP/2CK3-ADP_decoy_scores.csv |
2CEM-2AH | data/2C/2CEM-2AH/2CEM-2AH_ligand.pdbqt | data/2C/2CEM-2AH/2CEM-2AH_target.pdbqt | data/2C/2CEM-2AH/2CEM-2AH_decoys.pdbqt | data/2C/2CEM-2AH/2CEM-2AH_decoy_scores.csv |
2CM7-IZD | data/2C/2CM7-IZD/2CM7-IZD_ligand.pdbqt | data/2C/2CM7-IZD/2CM7-IZD_target.pdbqt | data/2C/2CM7-IZD/2CM7-IZD_decoys.pdbqt | data/2C/2CM7-IZD/2CM7-IZD_decoy_scores.csv |
2C2A-ADP | data/2C/2C2A-ADP/2C2A-ADP_ligand.pdbqt | data/2C/2C2A-ADP/2C2A-ADP_target.pdbqt | data/2C/2C2A-ADP/2C2A-ADP_decoys.pdbqt | data/2C/2C2A-ADP/2C2A-ADP_decoy_scores.csv |
2C75-RSA | data/2C/2C75-RSA/2C75-RSA_ligand.pdbqt | data/2C/2C75-RSA/2C75-RSA_target.pdbqt | data/2C/2C75-RSA/2C75-RSA_decoys.pdbqt | data/2C/2C75-RSA/2C75-RSA_decoy_scores.csv |
2CBT-TH2 | data/2C/2CBT-TH2/2CBT-TH2_ligand.pdbqt | data/2C/2CBT-TH2/2CBT-TH2_target.pdbqt | data/2C/2CBT-TH2/2CBT-TH2_decoys.pdbqt | data/2C/2CBT-TH2/2CBT-TH2_decoy_scores.csv |
2CXR-6PG | data/2C/2CXR-6PG/2CXR-6PG_ligand.pdbqt | data/2C/2CXR-6PG/2CXR-6PG_target.pdbqt | data/2C/2CXR-6PG/2CXR-6PG_decoys.pdbqt | data/2C/2CXR-6PG/2CXR-6PG_decoy_scores.csv |
2C90-C1M | data/2C/2C90-C1M/2C90-C1M_ligand.pdbqt | data/2C/2C90-C1M/2C90-C1M_target.pdbqt | data/2C/2C90-C1M/2C90-C1M_decoys.pdbqt | data/2C/2C90-C1M/2C90-C1M_decoy_scores.csv |
2CC7-LUM | data/2C/2CC7-LUM/2CC7-LUM_ligand.pdbqt | data/2C/2CC7-LUM/2CC7-LUM_target.pdbqt | data/2C/2CC7-LUM/2CC7-LUM_decoys.pdbqt | data/2C/2CC7-LUM/2CC7-LUM_decoy_scores.csv |
2C4W-GAJ | data/2C/2C4W-GAJ/2C4W-GAJ_ligand.pdbqt | data/2C/2C4W-GAJ/2C4W-GAJ_target.pdbqt | data/2C/2C4W-GAJ/2C4W-GAJ_decoys.pdbqt | data/2C/2C4W-GAJ/2C4W-GAJ_decoy_scores.csv |
2CJF-RP4 | data/2C/2CJF-RP4/2CJF-RP4_ligand.pdbqt | data/2C/2CJF-RP4/2CJF-RP4_target.pdbqt | data/2C/2CJF-RP4/2CJF-RP4_decoys.pdbqt | data/2C/2CJF-RP4/2CJF-RP4_decoy_scores.csv |
2CLL-PLS | data/2C/2CLL-PLS/2CLL-PLS_ligand.pdbqt | data/2C/2CLL-PLS/2CLL-PLS_target.pdbqt | data/2C/2CLL-PLS/2CLL-PLS_decoys.pdbqt | data/2C/2CLL-PLS/2CLL-PLS_decoy_scores.csv |
2C0T-L3G | data/2C/2C0T-L3G/2C0T-L3G_ligand.pdbqt | data/2C/2C0T-L3G/2C0T-L3G_target.pdbqt | data/2C/2C0T-L3G/2C0T-L3G_decoys.pdbqt | data/2C/2C0T-L3G/2C0T-L3G_decoy_scores.csv |
2C8V-ATP | data/2C/2C8V-ATP/2C8V-ATP_ligand.pdbqt | data/2C/2C8V-ATP/2C8V-ATP_target.pdbqt | data/2C/2C8V-ATP/2C8V-ATP_decoys.pdbqt | data/2C/2C8V-ATP/2C8V-ATP_decoy_scores.csv |
2CJI-GSK | data/2C/2CJI-GSK/2CJI-GSK_ligand.pdbqt | data/2C/2CJI-GSK/2CJI-GSK_target.pdbqt | data/2C/2CJI-GSK/2CJI-GSK_decoys.pdbqt | data/2C/2CJI-GSK/2CJI-GSK_decoy_scores.csv |
2C66-RM2 | data/2C/2C66-RM2/2C66-RM2_ligand.pdbqt | data/2C/2C66-RM2/2C66-RM2_target.pdbqt | data/2C/2C66-RM2/2C66-RM2_decoys.pdbqt | data/2C/2C66-RM2/2C66-RM2_decoy_scores.csv |
2CL7-XY2 | data/2C/2CL7-XY2/2CL7-XY2_ligand.pdbqt | data/2C/2CL7-XY2/2CL7-XY2_target.pdbqt | data/2C/2CL7-XY2/2CL7-XY2_decoys.pdbqt | data/2C/2CL7-XY2/2CL7-XY2_decoy_scores.csv |
2C8M-LPA | data/2C/2C8M-LPA/2C8M-LPA_ligand.pdbqt | data/2C/2C8M-LPA/2C8M-LPA_target.pdbqt | data/2C/2C8M-LPA/2C8M-LPA_decoys.pdbqt | data/2C/2C8M-LPA/2C8M-LPA_decoy_scores.csv |
2CF9-348 | data/2C/2CF9-348/2CF9-348_ligand.pdbqt | data/2C/2CF9-348/2CF9-348_target.pdbqt | data/2C/2CF9-348/2CF9-348_decoys.pdbqt | data/2C/2CF9-348/2CF9-348_decoy_scores.csv |
2CXT-F6P | data/2C/2CXT-F6P/2CXT-F6P_ligand.pdbqt | data/2C/2CXT-F6P/2CXT-F6P_target.pdbqt | data/2C/2CXT-F6P/2CXT-F6P_decoys.pdbqt | data/2C/2CXT-F6P/2CXT-F6P_decoy_scores.csv |
2C1X-UDP | data/2C/2C1X-UDP/2C1X-UDP_ligand.pdbqt | data/2C/2C1X-UDP/2C1X-UDP_target.pdbqt | data/2C/2C1X-UDP/2C1X-UDP_decoys.pdbqt | data/2C/2C1X-UDP/2C1X-UDP_decoy_scores.csv |
2CLF-F6F | data/2C/2CLF-F6F/2CLF-F6F_ligand.pdbqt | data/2C/2CLF-F6F/2CLF-F6F_target.pdbqt | data/2C/2CLF-F6F/2CLF-F6F_decoys.pdbqt | data/2C/2CLF-F6F/2CLF-F6F_decoy_scores.csv |
2CXQ-S6P | data/2C/2CXQ-S6P/2CXQ-S6P_ligand.pdbqt | data/2C/2CXQ-S6P/2CXQ-S6P_target.pdbqt | data/2C/2CXQ-S6P/2CXQ-S6P_decoys.pdbqt | data/2C/2CXQ-S6P/2CXQ-S6P_decoy_scores.csv |
2CUK-NHE | data/2C/2CUK-NHE/2CUK-NHE_ligand.pdbqt | data/2C/2CUK-NHE/2CUK-NHE_target.pdbqt | data/2C/2CUK-NHE/2CUK-NHE_decoys.pdbqt | data/2C/2CUK-NHE/2CUK-NHE_decoy_scores.csv |
2CL5-SAM | data/2C/2CL5-SAM/2CL5-SAM_ligand.pdbqt | data/2C/2CL5-SAM/2CL5-SAM_target.pdbqt | data/2C/2CL5-SAM/2CL5-SAM_decoys.pdbqt | data/2C/2CL5-SAM/2CL5-SAM_decoy_scores.csv |
2CL0-XY2 | data/2C/2CL0-XY2/2CL0-XY2_ligand.pdbqt | data/2C/2CL0-XY2/2CL0-XY2_target.pdbqt | data/2C/2CL0-XY2/2CL0-XY2_decoys.pdbqt | data/2C/2CL0-XY2/2CL0-XY2_decoy_scores.csv |
2CL6-CAG | data/2C/2CL6-CAG/2CL6-CAG_ligand.pdbqt | data/2C/2CL6-CAG/2CL6-CAG_target.pdbqt | data/2C/2CL6-CAG/2CL6-CAG_decoys.pdbqt | data/2C/2CL6-CAG/2CL6-CAG_decoy_scores.csv |
2CLL-F9F | data/2C/2CLL-F9F/2CLL-F9F_ligand.pdbqt | data/2C/2CLL-F9F/2CLL-F9F_target.pdbqt | data/2C/2CLL-F9F/2CLL-F9F_decoys.pdbqt | data/2C/2CLL-F9F/2CLL-F9F_decoy_scores.csv |
2CBO-TH2 | data/2C/2CBO-TH2/2CBO-TH2_ligand.pdbqt | data/2C/2CBO-TH2/2CBO-TH2_target.pdbqt | data/2C/2CBO-TH2/2CBO-TH2_decoys.pdbqt | data/2C/2CBO-TH2/2CBO-TH2_decoy_scores.csv |
2CFC-NAD | data/2C/2CFC-NAD/2CFC-NAD_ligand.pdbqt | data/2C/2CFC-NAD/2CFC-NAD_target.pdbqt | data/2C/2CFC-NAD/2CFC-NAD_decoys.pdbqt | data/2C/2CFC-NAD/2CFC-NAD_decoy_scores.csv |
2CCV-A2G | data/2C/2CCV-A2G/2CCV-A2G_ligand.pdbqt | data/2C/2CCV-A2G/2CCV-A2G_target.pdbqt | data/2C/2CCV-A2G/2CCV-A2G_decoys.pdbqt | data/2C/2CCV-A2G/2CCV-A2G_decoy_scores.csv |
2CJG-PMP | data/2C/2CJG-PMP/2CJG-PMP_ligand.pdbqt | data/2C/2CJG-PMP/2CJG-PMP_target.pdbqt | data/2C/2CJG-PMP/2CJG-PMP_decoys.pdbqt | data/2C/2CJG-PMP/2CJG-PMP_decoy_scores.csv |
2CLD-GDP | data/2C/2CLD-GDP/2CLD-GDP_ligand.pdbqt | data/2C/2CLD-GDP/2CLD-GDP_target.pdbqt | data/2C/2CLD-GDP/2CLD-GDP_decoys.pdbqt | data/2C/2CLD-GDP/2CLD-GDP_decoy_scores.csv |
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