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 ⌀ |
|---|---|---|---|---|
7CI5-MPO | data/7C/7CI5-MPO/7CI5-MPO_ligand.pdbqt | data/7C/7CI5-MPO/7CI5-MPO_target.pdbqt | data/7C/7CI5-MPO/7CI5-MPO_decoys.pdbqt | data/7C/7CI5-MPO/7CI5-MPO_decoy_scores.csv |
7CNS-PMV | data/7C/7CNS-PMV/7CNS-PMV_ligand.pdbqt | data/7C/7CNS-PMV/7CNS-PMV_target.pdbqt | data/7C/7CNS-PMV/7CNS-PMV_decoys.pdbqt | data/7C/7CNS-PMV/7CNS-PMV_decoy_scores.csv |
7C6U-K36 | data/7C/7C6U-K36/7C6U-K36_ligand.pdbqt | data/7C/7C6U-K36/7C6U-K36_target.pdbqt | data/7C/7C6U-K36/7C6U-K36_decoys.pdbqt | data/7C/7C6U-K36/7C6U-K36_decoy_scores.csv |
7C9Q-AMP | data/7C/7C9Q-AMP/7C9Q-AMP_ligand.pdbqt | data/7C/7C9Q-AMP/7C9Q-AMP_target.pdbqt | data/7C/7C9Q-AMP/7C9Q-AMP_decoys.pdbqt | data/7C/7C9Q-AMP/7C9Q-AMP_decoy_scores.csv |
7C3Q-NUT | data/7C/7C3Q-NUT/7C3Q-NUT_ligand.pdbqt | data/7C/7C3Q-NUT/7C3Q-NUT_target.pdbqt | data/7C/7C3Q-NUT/7C3Q-NUT_decoys.pdbqt | data/7C/7C3Q-NUT/7C3Q-NUT_decoy_scores.csv |
7C2H-ATP | data/7C/7C2H-ATP/7C2H-ATP_ligand.pdbqt | data/7C/7C2H-ATP/7C2H-ATP_target.pdbqt | data/7C/7C2H-ATP/7C2H-ATP_decoys.pdbqt | data/7C/7C2H-ATP/7C2H-ATP_decoy_scores.csv |
7C5O-NAD | data/7C/7C5O-NAD/7C5O-NAD_ligand.pdbqt | data/7C/7C5O-NAD/7C5O-NAD_target.pdbqt | data/7C/7C5O-NAD/7C5O-NAD_decoys.pdbqt | data/7C/7C5O-NAD/7C5O-NAD_decoy_scores.csv |
7CD4-BTB | data/7C/7CD4-BTB/7CD4-BTB_ligand.pdbqt | data/7C/7CD4-BTB/7CD4-BTB_target.pdbqt | data/7C/7CD4-BTB/7CD4-BTB_decoys.pdbqt | data/7C/7CD4-BTB/7CD4-BTB_decoy_scores.csv |
7CXB-TD2 | data/7C/7CXB-TD2/7CXB-TD2_ligand.pdbqt | data/7C/7CXB-TD2/7CXB-TD2_target.pdbqt | data/7C/7CXB-TD2/7CXB-TD2_decoys.pdbqt | data/7C/7CXB-TD2/7CXB-TD2_decoy_scores.csv |
7CSJ-51G | data/7C/7CSJ-51G/7CSJ-51G_ligand.pdbqt | data/7C/7CSJ-51G/7CSJ-51G_target.pdbqt | data/7C/7CSJ-51G/7CSJ-51G_decoys.pdbqt | data/7C/7CSJ-51G/7CSJ-51G_decoy_scores.csv |
7COU-HTG | data/7C/7COU-HTG/7COU-HTG_ligand.pdbqt | data/7C/7COU-HTG/7COU-HTG_target.pdbqt | data/7C/7COU-HTG/7COU-HTG_decoys.pdbqt | data/7C/7COU-HTG/7COU-HTG_decoy_scores.csv |
7CRK-RET | data/7C/7CRK-RET/7CRK-RET_ligand.pdbqt | data/7C/7CRK-RET/7CRK-RET_target.pdbqt | data/7C/7CRK-RET/7CRK-RET_decoys.pdbqt | data/7C/7CRK-RET/7CRK-RET_decoy_scores.csv |
7CVR-STQ | data/7C/7CVR-STQ/7CVR-STQ_ligand.pdbqt | data/7C/7CVR-STQ/7CVR-STQ_target.pdbqt | data/7C/7CVR-STQ/7CVR-STQ_decoys.pdbqt | data/7C/7CVR-STQ/7CVR-STQ_decoy_scores.csv |
7C8I-PEP | data/7C/7C8I-PEP/7C8I-PEP_ligand.pdbqt | data/7C/7C8I-PEP/7C8I-PEP_target.pdbqt | data/7C/7C8I-PEP/7C8I-PEP_decoys.pdbqt | data/7C/7C8I-PEP/7C8I-PEP_decoy_scores.csv |
7C89-FLC | data/7C/7C89-FLC/7C89-FLC_ligand.pdbqt | data/7C/7C89-FLC/7C89-FLC_target.pdbqt | data/7C/7C89-FLC/7C89-FLC_decoys.pdbqt | data/7C/7C89-FLC/7C89-FLC_decoy_scores.csv |
7CS5-GEF | data/7C/7CS5-GEF/7CS5-GEF_ligand.pdbqt | data/7C/7CS5-GEF/7CS5-GEF_target.pdbqt | data/7C/7CS5-GEF/7CS5-GEF_decoys.pdbqt | data/7C/7CS5-GEF/7CS5-GEF_decoy_scores.csv |
7CRX-RET | data/7C/7CRX-RET/7CRX-RET_ligand.pdbqt | data/7C/7CRX-RET/7CRX-RET_target.pdbqt | data/7C/7CRX-RET/7CRX-RET_decoys.pdbqt | data/7C/7CRX-RET/7CRX-RET_decoy_scores.csv |
7CIC-FZ0 | data/7C/7CIC-FZ0/7CIC-FZ0_ligand.pdbqt | data/7C/7CIC-FZ0/7CIC-FZ0_target.pdbqt | data/7C/7CIC-FZ0/7CIC-FZ0_decoys.pdbqt | data/7C/7CIC-FZ0/7CIC-FZ0_decoy_scores.csv |
7C64-P33 | data/7C/7C64-P33/7C64-P33_ligand.pdbqt | data/7C/7C64-P33/7C64-P33_target.pdbqt | data/7C/7C64-P33/7C64-P33_decoys.pdbqt | data/7C/7C64-P33/7C64-P33_decoy_scores.csv |
7CHT-FZO | data/7C/7CHT-FZO/7CHT-FZO_ligand.pdbqt | data/7C/7CHT-FZO/7CHT-FZO_target.pdbqt | data/7C/7CHT-FZO/7CHT-FZO_decoys.pdbqt | data/7C/7CHT-FZO/7CHT-FZO_decoy_scores.csv |
7CKI-ATP | data/7C/7CKI-ATP/7CKI-ATP_ligand.pdbqt | data/7C/7CKI-ATP/7CKI-ATP_target.pdbqt | data/7C/7CKI-ATP/7CKI-ATP_decoys.pdbqt | data/7C/7CKI-ATP/7CKI-ATP_decoy_scores.csv |
7C47-C | data/7C/7C47-C/7C47-C_ligand.pdbqt | data/7C/7C47-C/7C47-C_target.pdbqt | data/7C/7C47-C/7C47-C_decoys.pdbqt | data/7C/7C47-C/7C47-C_decoy_scores.csv |
7C7N-FKR | data/7C/7C7N-FKR/7C7N-FKR_ligand.pdbqt | data/7C/7C7N-FKR/7C7N-FKR_target.pdbqt | data/7C/7C7N-FKR/7C7N-FKR_decoys.pdbqt | data/7C/7C7N-FKR/7C7N-FKR_decoy_scores.csv |
7C44-NUT | data/7C/7C44-NUT/7C44-NUT_ligand.pdbqt | data/7C/7C44-NUT/7C44-NUT_target.pdbqt | data/7C/7C44-NUT/7C44-NUT_decoys.pdbqt | data/7C/7C44-NUT/7C44-NUT_decoy_scores.csv |
7CVR-ZP6 | data/7C/7CVR-ZP6/7CVR-ZP6_ligand.pdbqt | data/7C/7CVR-ZP6/7CVR-ZP6_target.pdbqt | data/7C/7CVR-ZP6/7CVR-ZP6_decoys.pdbqt | data/7C/7CVR-ZP6/7CVR-ZP6_decoy_scores.csv |
7CNO-GTP | data/7C/7CNO-GTP/7CNO-GTP_ligand.pdbqt | data/7C/7CNO-GTP/7CNO-GTP_target.pdbqt | data/7C/7CNO-GTP/7CNO-GTP_decoys.pdbqt | data/7C/7CNO-GTP/7CNO-GTP_decoy_scores.csv |
7CGQ-ARA | data/7C/7CGQ-ARA/7CGQ-ARA_ligand.pdbqt | data/7C/7CGQ-ARA/7CGQ-ARA_target.pdbqt | data/7C/7CGQ-ARA/7CGQ-ARA_decoys.pdbqt | data/7C/7CGQ-ARA/7CGQ-ARA_decoy_scores.csv |
7CCW-STL | data/7C/7CCW-STL/7CCW-STL_ligand.pdbqt | data/7C/7CCW-STL/7CCW-STL_target.pdbqt | data/7C/7CCW-STL/7CCW-STL_decoys.pdbqt | data/7C/7CCW-STL/7CCW-STL_decoy_scores.csv |
7C1O-GDP | data/7C/7C1O-GDP/7C1O-GDP_ligand.pdbqt | data/7C/7C1O-GDP/7C1O-GDP_target.pdbqt | null | null |
7CRY-OLA | data/7C/7CRY-OLA/7CRY-OLA_ligand.pdbqt | data/7C/7CRY-OLA/7CRY-OLA_target.pdbqt | data/7C/7CRY-OLA/7CRY-OLA_decoys.pdbqt | data/7C/7CRY-OLA/7CRY-OLA_decoy_scores.csv |
7C2F-LAB | data/7C/7C2F-LAB/7C2F-LAB_ligand.pdbqt | data/7C/7C2F-LAB/7C2F-LAB_target.pdbqt | data/7C/7C2F-LAB/7C2F-LAB_decoys.pdbqt | data/7C/7C2F-LAB/7C2F-LAB_decoy_scores.csv |
7C04-FEU | data/7C/7C04-FEU/7C04-FEU_ligand.pdbqt | data/7C/7C04-FEU/7C04-FEU_target.pdbqt | data/7C/7C04-FEU/7C04-FEU_decoys.pdbqt | data/7C/7C04-FEU/7C04-FEU_decoy_scores.csv |
7C5Q-G3H | data/7C/7C5Q-G3H/7C5Q-G3H_ligand.pdbqt | data/7C/7C5Q-G3H/7C5Q-G3H_target.pdbqt | data/7C/7C5Q-G3H/7C5Q-G3H_decoys.pdbqt | data/7C/7C5Q-G3H/7C5Q-G3H_decoy_scores.csv |
7C15-FGO | data/7C/7C15-FGO/7C15-FGO_ligand.pdbqt | data/7C/7C15-FGO/7C15-FGO_target.pdbqt | data/7C/7C15-FGO/7C15-FGO_decoys.pdbqt | data/7C/7C15-FGO/7C15-FGO_decoy_scores.csv |
7CTL-NAI | data/7C/7CTL-NAI/7CTL-NAI_ligand.pdbqt | data/7C/7CTL-NAI/7CTL-NAI_target.pdbqt | data/7C/7CTL-NAI/7CTL-NAI_decoys.pdbqt | data/7C/7CTL-NAI/7CTL-NAI_decoy_scores.csv |
7C7O-FKU | data/7C/7C7O-FKU/7C7O-FKU_ligand.pdbqt | data/7C/7C7O-FKU/7C7O-FKU_target.pdbqt | data/7C/7C7O-FKU/7C7O-FKU_decoys.pdbqt | data/7C/7C7O-FKU/7C7O-FKU_decoy_scores.csv |
7C0O-FGO | data/7C/7C0O-FGO/7C0O-FGO_ligand.pdbqt | data/7C/7C0O-FGO/7C0O-FGO_target.pdbqt | data/7C/7C0O-FGO/7C0O-FGO_decoys.pdbqt | data/7C/7C0O-FGO/7C0O-FGO_decoy_scores.csv |
7CV8-SFG | data/7C/7CV8-SFG/7CV8-SFG_ligand.pdbqt | data/7C/7CV8-SFG/7CV8-SFG_target.pdbqt | data/7C/7CV8-SFG/7CV8-SFG_decoys.pdbqt | data/7C/7CV8-SFG/7CV8-SFG_decoy_scores.csv |
7CE9-PQQ | data/7C/7CE9-PQQ/7CE9-PQQ_ligand.pdbqt | data/7C/7CE9-PQQ/7CE9-PQQ_target.pdbqt | data/7C/7CE9-PQQ/7CE9-PQQ_decoys.pdbqt | data/7C/7CE9-PQQ/7CE9-PQQ_decoy_scores.csv |
7CSH-GEC | data/7C/7CSH-GEC/7CSH-GEC_ligand.pdbqt | data/7C/7CSH-GEC/7CSH-GEC_target.pdbqt | data/7C/7CSH-GEC/7CSH-GEC_decoys.pdbqt | data/7C/7CSH-GEC/7CSH-GEC_decoy_scores.csv |
7C41-GDP | data/7C/7C41-GDP/7C41-GDP_ligand.pdbqt | data/7C/7C41-GDP/7C41-GDP_target.pdbqt | data/7C/7C41-GDP/7C41-GDP_decoys.pdbqt | data/7C/7C41-GDP/7C41-GDP_decoy_scores.csv |
7COZ-Q39 | data/7C/7COZ-Q39/7COZ-Q39_ligand.pdbqt | data/7C/7COZ-Q39/7COZ-Q39_target.pdbqt | data/7C/7COZ-Q39/7COZ-Q39_decoys.pdbqt | data/7C/7COZ-Q39/7COZ-Q39_decoy_scores.csv |
7CV7-SAM | data/7C/7CV7-SAM/7CV7-SAM_ligand.pdbqt | data/7C/7CV7-SAM/7CV7-SAM_target.pdbqt | data/7C/7CV7-SAM/7CV7-SAM_decoys.pdbqt | data/7C/7CV7-SAM/7CV7-SAM_decoy_scores.csv |
7C5Q-NAD | data/7C/7C5Q-NAD/7C5Q-NAD_ligand.pdbqt | data/7C/7C5Q-NAD/7C5Q-NAD_target.pdbqt | data/7C/7C5Q-NAD/7C5Q-NAD_decoys.pdbqt | data/7C/7C5Q-NAD/7C5Q-NAD_decoy_scores.csv |
7CRL-OLA | data/7C/7CRL-OLA/7CRL-OLA_ligand.pdbqt | data/7C/7CRL-OLA/7CRL-OLA_target.pdbqt | data/7C/7CRL-OLA/7CRL-OLA_decoys.pdbqt | data/7C/7CRL-OLA/7CRL-OLA_decoy_scores.csv |
7CRT-RET | data/7C/7CRT-RET/7CRT-RET_ligand.pdbqt | data/7C/7CRT-RET/7CRT-RET_target.pdbqt | data/7C/7CRT-RET/7CRT-RET_decoys.pdbqt | data/7C/7CRT-RET/7CRT-RET_decoy_scores.csv |
7CRL-RET | data/7C/7CRL-RET/7CRL-RET_ligand.pdbqt | data/7C/7CRL-RET/7CRL-RET_target.pdbqt | data/7C/7CRL-RET/7CRL-RET_decoys.pdbqt | data/7C/7CRL-RET/7CRL-RET_decoy_scores.csv |
7CJI-HTG | data/7C/7CJI-HTG/7CJI-HTG_ligand.pdbqt | data/7C/7CJI-HTG/7CJI-HTG_target.pdbqt | data/7C/7CJI-HTG/7CJI-HTG_decoys.pdbqt | data/7C/7CJI-HTG/7CJI-HTG_decoy_scores.csv |
7CIM-G0F | data/7C/7CIM-G0F/7CIM-G0F_ligand.pdbqt | data/7C/7CIM-G0F/7CIM-G0F_target.pdbqt | data/7C/7CIM-G0F/7CIM-G0F_decoys.pdbqt | data/7C/7CIM-G0F/7CIM-G0F_decoy_scores.csv |
7CIB-FYR | data/7C/7CIB-FYR/7CIB-FYR_ligand.pdbqt | data/7C/7CIB-FYR/7CIB-FYR_target.pdbqt | data/7C/7CIB-FYR/7CIB-FYR_decoys.pdbqt | data/7C/7CIB-FYR/7CIB-FYR_decoy_scores.csv |
7CEO-PMP | data/7C/7CEO-PMP/7CEO-PMP_ligand.pdbqt | data/7C/7CEO-PMP/7CEO-PMP_target.pdbqt | data/7C/7CEO-PMP/7CEO-PMP_decoys.pdbqt | data/7C/7CEO-PMP/7CEO-PMP_decoy_scores.csv |
7C6B-K2R | data/7C/7C6B-K2R/7C6B-K2R_ligand.pdbqt | data/7C/7C6B-K2R/7C6B-K2R_target.pdbqt | data/7C/7C6B-K2R/7C6B-K2R_decoys.pdbqt | data/7C/7C6B-K2R/7C6B-K2R_decoy_scores.csv |
7CD0-FWL | data/7C/7CD0-FWL/7CD0-FWL_ligand.pdbqt | data/7C/7CD0-FWL/7CD0-FWL_target.pdbqt | data/7C/7CD0-FWL/7CD0-FWL_decoys.pdbqt | data/7C/7CD0-FWL/7CD0-FWL_decoy_scores.csv |
7C2X-UDP | data/7C/7C2X-UDP/7C2X-UDP_ligand.pdbqt | data/7C/7C2X-UDP/7C2X-UDP_target.pdbqt | data/7C/7C2X-UDP/7C2X-UDP_decoys.pdbqt | data/7C/7C2X-UDP/7C2X-UDP_decoy_scores.csv |
7CQR-GEU | data/7C/7CQR-GEU/7CQR-GEU_ligand.pdbqt | data/7C/7CQR-GEU/7CQR-GEU_target.pdbqt | data/7C/7CQR-GEU/7CQR-GEU_decoys.pdbqt | data/7C/7CQR-GEU/7CQR-GEU_decoy_scores.csv |
7C0W-FGO | data/7C/7C0W-FGO/7C0W-FGO_ligand.pdbqt | data/7C/7C0W-FGO/7C0W-FGO_target.pdbqt | data/7C/7C0W-FGO/7C0W-FGO_decoys.pdbqt | data/7C/7C0W-FGO/7C0W-FGO_decoy_scores.csv |
7CBJ-FTX | data/7C/7CBJ-FTX/7CBJ-FTX_ligand.pdbqt | data/7C/7CBJ-FTX/7CBJ-FTX_target.pdbqt | data/7C/7CBJ-FTX/7CBJ-FTX_decoys.pdbqt | data/7C/7CBJ-FTX/7CBJ-FTX_decoy_scores.csv |
7CGS-BCN | data/7C/7CGS-BCN/7CGS-BCN_ligand.pdbqt | data/7C/7CGS-BCN/7CGS-BCN_target.pdbqt | data/7C/7CGS-BCN/7CGS-BCN_decoys.pdbqt | data/7C/7CGS-BCN/7CGS-BCN_decoy_scores.csv |
7CL9-ASD | data/7C/7CL9-ASD/7CL9-ASD_ligand.pdbqt | data/7C/7CL9-ASD/7CL9-ASD_target.pdbqt | data/7C/7CL9-ASD/7CL9-ASD_decoys.pdbqt | data/7C/7CL9-ASD/7CL9-ASD_decoy_scores.csv |
7C3H-LYS | data/7C/7C3H-LYS/7C3H-LYS_ligand.pdbqt | data/7C/7C3H-LYS/7C3H-LYS_target.pdbqt | data/7C/7C3H-LYS/7C3H-LYS_decoys.pdbqt | data/7C/7C3H-LYS/7C3H-LYS_decoy_scores.csv |
7C5R-DG4 | data/7C/7C5R-DG4/7C5R-DG4_ligand.pdbqt | data/7C/7C5R-DG4/7C5R-DG4_target.pdbqt | data/7C/7C5R-DG4/7C5R-DG4_decoys.pdbqt | data/7C/7C5R-DG4/7C5R-DG4_decoy_scores.csv |
7CT9-SAH | data/7C/7CT9-SAH/7CT9-SAH_ligand.pdbqt | data/7C/7CT9-SAH/7CT9-SAH_target.pdbqt | data/7C/7CT9-SAH/7CT9-SAH_decoys.pdbqt | data/7C/7CT9-SAH/7CT9-SAH_decoy_scores.csv |
7CRK-OLA | data/7C/7CRK-OLA/7CRK-OLA_ligand.pdbqt | data/7C/7CRK-OLA/7CRK-OLA_target.pdbqt | data/7C/7CRK-OLA/7CRK-OLA_decoys.pdbqt | data/7C/7CRK-OLA/7CRK-OLA_decoy_scores.csv |
7C1Y-ADP | data/7C/7C1Y-ADP/7C1Y-ADP_ligand.pdbqt | data/7C/7C1Y-ADP/7C1Y-ADP_target.pdbqt | data/7C/7C1Y-ADP/7C1Y-ADP_decoys.pdbqt | data/7C/7C1Y-ADP/7C1Y-ADP_decoy_scores.csv |
7C19-FGO | data/7C/7C19-FGO/7C19-FGO_ligand.pdbqt | data/7C/7C19-FGO/7C19-FGO_target.pdbqt | data/7C/7C19-FGO/7C19-FGO_decoys.pdbqt | data/7C/7C19-FGO/7C19-FGO_decoy_scores.csv |
7CS1-NMY | data/7C/7CS1-NMY/7CS1-NMY_ligand.pdbqt | data/7C/7CS1-NMY/7CS1-NMY_target.pdbqt | data/7C/7CS1-NMY/7CS1-NMY_decoys.pdbqt | data/7C/7CS1-NMY/7CS1-NMY_decoy_scores.csv |
7CI9-FYL | data/7C/7CI9-FYL/7CI9-FYL_ligand.pdbqt | data/7C/7CI9-FYL/7CI9-FYL_target.pdbqt | data/7C/7CI9-FYL/7CI9-FYL_decoys.pdbqt | data/7C/7CI9-FYL/7CI9-FYL_decoy_scores.csv |
7CIJ-G0C | data/7C/7CIJ-G0C/7CIJ-G0C_ligand.pdbqt | data/7C/7CIJ-G0C/7CIJ-G0C_target.pdbqt | data/7C/7CIJ-G0C/7CIJ-G0C_decoys.pdbqt | data/7C/7CIJ-G0C/7CIJ-G0C_decoy_scores.csv |
7CXU-NAD | data/7C/7CXU-NAD/7CXU-NAD_ligand.pdbqt | data/7C/7CXU-NAD/7CXU-NAD_target.pdbqt | data/7C/7CXU-NAD/7CXU-NAD_decoys.pdbqt | data/7C/7CXU-NAD/7CXU-NAD_decoy_scores.csv |
7CRS-RET | data/7C/7CRS-RET/7CRS-RET_ligand.pdbqt | data/7C/7CRS-RET/7CRS-RET_target.pdbqt | data/7C/7CRS-RET/7CRS-RET_decoys.pdbqt | data/7C/7CRS-RET/7CRS-RET_decoy_scores.csv |
3FC6-REA | data/3F/3FC6-REA/3FC6-REA_ligand.pdbqt | data/3F/3FC6-REA/3FC6-REA_target.pdbqt | data/3F/3FC6-REA/3FC6-REA_decoys.pdbqt | data/3F/3FC6-REA/3FC6-REA_decoy_scores.csv |
3F8P-NAD | data/3F/3F8P-NAD/3F8P-NAD_ligand.pdbqt | data/3F/3F8P-NAD/3F8P-NAD_target.pdbqt | data/3F/3F8P-NAD/3F8P-NAD_decoys.pdbqt | data/3F/3F8P-NAD/3F8P-NAD_decoy_scores.csv |
3FGU-ANP | data/3F/3FGU-ANP/3FGU-ANP_ligand.pdbqt | data/3F/3FGU-ANP/3FGU-ANP_target.pdbqt | data/3F/3FGU-ANP/3FGU-ANP_decoys.pdbqt | data/3F/3FGU-ANP/3FGU-ANP_decoy_scores.csv |
3FWJ-CAM | data/3F/3FWJ-CAM/3FWJ-CAM_ligand.pdbqt | data/3F/3FWJ-CAM/3FWJ-CAM_target.pdbqt | data/3F/3FWJ-CAM/3FWJ-CAM_decoys.pdbqt | data/3F/3FWJ-CAM/3FWJ-CAM_decoy_scores.csv |
3FAL-LO2 | data/3F/3FAL-LO2/3FAL-LO2_ligand.pdbqt | data/3F/3FAL-LO2/3FAL-LO2_target.pdbqt | data/3F/3FAL-LO2/3FAL-LO2_decoys.pdbqt | data/3F/3FAL-LO2/3FAL-LO2_decoy_scores.csv |
3FML-FML | data/3F/3FML-FML/3FML-FML_ligand.pdbqt | data/3F/3FML-FML/3FML-FML_target.pdbqt | data/3F/3FML-FML/3FML-FML_decoys.pdbqt | data/3F/3FML-FML/3FML-FML_decoy_scores.csv |
3F10-8HG | data/3F/3F10-8HG/3F10-8HG_ligand.pdbqt | data/3F/3F10-8HG/3F10-8HG_target.pdbqt | data/3F/3F10-8HG/3F10-8HG_decoys.pdbqt | data/3F/3F10-8HG/3F10-8HG_decoy_scores.csv |
3FDX-ATP | data/3F/3FDX-ATP/3FDX-ATP_ligand.pdbqt | data/3F/3FDX-ATP/3FDX-ATP_target.pdbqt | data/3F/3FDX-ATP/3FDX-ATP_decoys.pdbqt | data/3F/3FDX-ATP/3FDX-ATP_decoy_scores.csv |
3FCE-ATP | data/3F/3FCE-ATP/3FCE-ATP_ligand.pdbqt | data/3F/3FCE-ATP/3FCE-ATP_target.pdbqt | data/3F/3FCE-ATP/3FCE-ATP_decoys.pdbqt | data/3F/3FCE-ATP/3FCE-ATP_decoy_scores.csv |
3F4F-UMP | data/3F/3F4F-UMP/3F4F-UMP_ligand.pdbqt | data/3F/3F4F-UMP/3F4F-UMP_target.pdbqt | data/3F/3F4F-UMP/3F4F-UMP_decoys.pdbqt | data/3F/3F4F-UMP/3F4F-UMP_decoy_scores.csv |
3FK7-4DM | data/3F/3FK7-4DM/3FK7-4DM_ligand.pdbqt | data/3F/3FK7-4DM/3FK7-4DM_target.pdbqt | data/3F/3FK7-4DM/3FK7-4DM_decoys.pdbqt | data/3F/3FK7-4DM/3FK7-4DM_decoy_scores.csv |
3F3A-TRP | data/3F/3F3A-TRP/3F3A-TRP_ligand.pdbqt | data/3F/3F3A-TRP/3F3A-TRP_target.pdbqt | data/3F/3F3A-TRP/3F3A-TRP_decoys.pdbqt | data/3F/3F3A-TRP/3F3A-TRP_decoy_scores.csv |
3FUU-ADN | data/3F/3FUU-ADN/3FUU-ADN_ligand.pdbqt | data/3F/3FUU-ADN/3FUU-ADN_target.pdbqt | data/3F/3FUU-ADN/3FUU-ADN_decoys.pdbqt | data/3F/3FUU-ADN/3FUU-ADN_decoy_scores.csv |
3FUW-MTA | data/3F/3FUW-MTA/3FUW-MTA_ligand.pdbqt | data/3F/3FUW-MTA/3FUW-MTA_target.pdbqt | data/3F/3FUW-MTA/3FUW-MTA_decoys.pdbqt | data/3F/3FUW-MTA/3FUW-MTA_decoy_scores.csv |
3FGU-BGC | data/3F/3FGU-BGC/3FGU-BGC_ligand.pdbqt | data/3F/3FGU-BGC/3FGU-BGC_target.pdbqt | data/3F/3FGU-BGC/3FGU-BGC_decoys.pdbqt | data/3F/3FGU-BGC/3FGU-BGC_decoy_scores.csv |
3F3T-1AU | data/3F/3F3T-1AU/3F3T-1AU_ligand.pdbqt | data/3F/3F3T-1AU/3F3T-1AU_target.pdbqt | data/3F/3F3T-1AU/3F3T-1AU_decoys.pdbqt | data/3F/3F3T-1AU/3F3T-1AU_decoy_scores.csv |
3FZT-4JZ | data/3F/3FZT-4JZ/3FZT-4JZ_ligand.pdbqt | data/3F/3FZT-4JZ/3FZT-4JZ_target.pdbqt | data/3F/3FZT-4JZ/3FZT-4JZ_decoys.pdbqt | data/3F/3FZT-4JZ/3FZT-4JZ_decoy_scores.csv |
3FZH-3BH | data/3F/3FZH-3BH/3FZH-3BH_ligand.pdbqt | data/3F/3FZH-3BH/3FZH-3BH_target.pdbqt | data/3F/3FZH-3BH/3FZH-3BH_decoys.pdbqt | data/3F/3FZH-3BH/3FZH-3BH_decoy_scores.csv |
3FH0-ADP | data/3F/3FH0-ADP/3FH0-ADP_ligand.pdbqt | data/3F/3FH0-ADP/3FH0-ADP_target.pdbqt | data/3F/3FH0-ADP/3FH0-ADP_decoys.pdbqt | data/3F/3FH0-ADP/3FH0-ADP_decoy_scores.csv |
3FWK-BGC | data/3F/3FWK-BGC/3FWK-BGC_ligand.pdbqt | data/3F/3FWK-BGC/3FWK-BGC_target.pdbqt | data/3F/3FWK-BGC/3FWK-BGC_decoys.pdbqt | data/3F/3FWK-BGC/3FWK-BGC_decoy_scores.csv |
3FCT-MMP | data/3F/3FCT-MMP/3FCT-MMP_ligand.pdbqt | data/3F/3FCT-MMP/3FCT-MMP_target.pdbqt | data/3F/3FCT-MMP/3FCT-MMP_decoys.pdbqt | data/3F/3FCT-MMP/3FCT-MMP_decoy_scores.csv |
3FRD-DHF | data/3F/3FRD-DHF/3FRD-DHF_ligand.pdbqt | data/3F/3FRD-DHF/3FRD-DHF_target.pdbqt | data/3F/3FRD-DHF/3FRD-DHF_decoys.pdbqt | data/3F/3FRD-DHF/3FRD-DHF_decoy_scores.csv |
3FXL-FLC | data/3F/3FXL-FLC/3FXL-FLC_ligand.pdbqt | data/3F/3FXL-FLC/3FXL-FLC_target.pdbqt | data/3F/3FXL-FLC/3FXL-FLC_decoys.pdbqt | data/3F/3FXL-FLC/3FXL-FLC_decoy_scores.csv |
3FEG-AMP | data/3F/3FEG-AMP/3FEG-AMP_ligand.pdbqt | data/3F/3FEG-AMP/3FEG-AMP_target.pdbqt | data/3F/3FEG-AMP/3FEG-AMP_decoys.pdbqt | data/3F/3FEG-AMP/3FEG-AMP_decoy_scores.csv |
3FGO-CZA | data/3F/3FGO-CZA/3FGO-CZA_ligand.pdbqt | data/3F/3FGO-CZA/3FGO-CZA_target.pdbqt | data/3F/3FGO-CZA/3FGO-CZA_decoys.pdbqt | data/3F/3FGO-CZA/3FGO-CZA_decoy_scores.csv |
3F61-ADP | data/3F/3F61-ADP/3F61-ADP_ligand.pdbqt | data/3F/3F61-ADP/3F61-ADP_target.pdbqt | data/3F/3F61-ADP/3F61-ADP_decoys.pdbqt | data/3F/3F61-ADP/3F61-ADP_decoy_scores.csv |
3FUE-BES | data/3F/3FUE-BES/3FUE-BES_ligand.pdbqt | data/3F/3FUE-BES/3FUE-BES_target.pdbqt | null | null |
3FU6-80G | data/3F/3FU6-80G/3FU6-80G_ligand.pdbqt | data/3F/3FU6-80G/3FU6-80G_target.pdbqt | null | null |
3F9M-GLC | data/3F/3F9M-GLC/3F9M-GLC_ligand.pdbqt | data/3F/3F9M-GLC/3F9M-GLC_target.pdbqt | data/3F/3F9M-GLC/3F9M-GLC_decoys.pdbqt | data/3F/3F9M-GLC/3F9M-GLC_decoy_scores.csv |
3FWF-CAM | data/3F/3FWF-CAM/3FWF-CAM_ligand.pdbqt | data/3F/3FWF-CAM/3FWF-CAM_target.pdbqt | data/3F/3FWF-CAM/3FWF-CAM_decoys.pdbqt | data/3F/3FWF-CAM/3FWF-CAM_decoy_scores.csv |
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