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 ⌀ |
|---|---|---|---|---|
1NGX-JEF | data/1N/1NGX-JEF/1NGX-JEF_ligand.pdbqt | data/1N/1NGX-JEF/1NGX-JEF_target.pdbqt | data/1N/1NGX-JEF/1NGX-JEF_decoys.pdbqt | data/1N/1NGX-JEF/1NGX-JEF_decoy_scores.csv |
1NZX-NAD | data/1N/1NZX-NAD/1NZX-NAD_ligand.pdbqt | data/1N/1NZX-NAD/1NZX-NAD_target.pdbqt | data/1N/1NZX-NAD/1NZX-NAD_decoys.pdbqt | data/1N/1NZX-NAD/1NZX-NAD_decoy_scores.csv |
1NT4-XGP | data/1N/1NT4-XGP/1NT4-XGP_ligand.pdbqt | data/1N/1NT4-XGP/1NT4-XGP_target.pdbqt | data/1N/1NT4-XGP/1NT4-XGP_decoys.pdbqt | data/1N/1NT4-XGP/1NT4-XGP_decoy_scores.csv |
1N8K-NAJ | data/1N/1N8K-NAJ/1N8K-NAJ_ligand.pdbqt | data/1N/1N8K-NAJ/1N8K-NAJ_target.pdbqt | data/1N/1N8K-NAJ/1N8K-NAJ_decoys.pdbqt | data/1N/1N8K-NAJ/1N8K-NAJ_decoy_scores.csv |
1NLK-ADP | data/1N/1NLK-ADP/1NLK-ADP_ligand.pdbqt | data/1N/1NLK-ADP/1NLK-ADP_target.pdbqt | data/1N/1NLK-ADP/1NLK-ADP_decoys.pdbqt | data/1N/1NLK-ADP/1NLK-ADP_decoy_scores.csv |
1NMS-161 | data/1N/1NMS-161/1NMS-161_ligand.pdbqt | data/1N/1NMS-161/1NMS-161_target.pdbqt | data/1N/1NMS-161/1NMS-161_decoys.pdbqt | data/1N/1NMS-161/1NMS-161_decoy_scores.csv |
1NVM-NAD | data/1N/1NVM-NAD/1NVM-NAD_ligand.pdbqt | data/1N/1NVM-NAD/1NVM-NAD_target.pdbqt | data/1N/1NVM-NAD/1NVM-NAD_decoys.pdbqt | data/1N/1NVM-NAD/1NVM-NAD_decoy_scores.csv |
1NQC-C4P | data/1N/1NQC-C4P/1NQC-C4P_ligand.pdbqt | data/1N/1NQC-C4P/1NQC-C4P_target.pdbqt | data/1N/1NQC-C4P/1NQC-C4P_decoys.pdbqt | data/1N/1NQC-C4P/1NQC-C4P_decoy_scores.csv |
1NHZ-486 | data/1N/1NHZ-486/1NHZ-486_ligand.pdbqt | data/1N/1NHZ-486/1NHZ-486_target.pdbqt | data/1N/1NHZ-486/1NHZ-486_decoys.pdbqt | data/1N/1NHZ-486/1NHZ-486_decoy_scores.csv |
1N5S-ADL | data/1N/1N5S-ADL/1N5S-ADL_ligand.pdbqt | data/1N/1N5S-ADL/1N5S-ADL_target.pdbqt | data/1N/1N5S-ADL/1N5S-ADL_decoys.pdbqt | data/1N/1N5S-ADL/1N5S-ADL_decoy_scores.csv |
1NJF-ADP | data/1N/1NJF-ADP/1NJF-ADP_ligand.pdbqt | data/1N/1NJF-ADP/1NJF-ADP_target.pdbqt | data/1N/1NJF-ADP/1NJF-ADP_decoys.pdbqt | data/1N/1NJF-ADP/1NJF-ADP_decoy_scores.csv |
1NUC-THP | data/1N/1NUC-THP/1NUC-THP_ligand.pdbqt | data/1N/1NUC-THP/1NUC-THP_target.pdbqt | data/1N/1NUC-THP/1NUC-THP_decoys.pdbqt | data/1N/1NUC-THP/1NUC-THP_decoy_scores.csv |
1NS4-BGC | data/1N/1NS4-BGC/1NS4-BGC_ligand.pdbqt | data/1N/1NS4-BGC/1NS4-BGC_target.pdbqt | data/1N/1NS4-BGC/1NS4-BGC_decoys.pdbqt | data/1N/1NS4-BGC/1NS4-BGC_decoy_scores.csv |
1N2E-APC | data/1N/1N2E-APC/1N2E-APC_ligand.pdbqt | data/1N/1N2E-APC/1N2E-APC_target.pdbqt | data/1N/1N2E-APC/1N2E-APC_decoys.pdbqt | data/1N/1N2E-APC/1N2E-APC_decoy_scores.csv |
1NI1-HFP | data/1N/1NI1-HFP/1NI1-HFP_ligand.pdbqt | data/1N/1NI1-HFP/1NI1-HFP_target.pdbqt | data/1N/1NI1-HFP/1NI1-HFP_decoys.pdbqt | data/1N/1NI1-HFP/1NI1-HFP_decoy_scores.csv |
1NHH-ANP | data/1N/1NHH-ANP/1NHH-ANP_ligand.pdbqt | data/1N/1NHH-ANP/1NHH-ANP_target.pdbqt | null | null |
1NEY-13P | data/1N/1NEY-13P/1NEY-13P_ligand.pdbqt | data/1N/1NEY-13P/1NEY-13P_target.pdbqt | data/1N/1NEY-13P/1NEY-13P_decoys.pdbqt | data/1N/1NEY-13P/1NEY-13P_decoy_scores.csv |
1NFQ-AOI | data/1N/1NFQ-AOI/1NFQ-AOI_ligand.pdbqt | data/1N/1NFQ-AOI/1NFQ-AOI_target.pdbqt | data/1N/1NFQ-AOI/1NFQ-AOI_decoys.pdbqt | data/1N/1NFQ-AOI/1NFQ-AOI_decoy_scores.csv |
1NSE-H4B | data/1N/1NSE-H4B/1NSE-H4B_ligand.pdbqt | data/1N/1NSE-H4B/1NSE-H4B_target.pdbqt | data/1N/1NSE-H4B/1NSE-H4B_decoys.pdbqt | data/1N/1NSE-H4B/1NSE-H4B_decoy_scores.csv |
1NVR-STU | data/1N/1NVR-STU/1NVR-STU_ligand.pdbqt | data/1N/1NVR-STU/1NVR-STU_target.pdbqt | data/1N/1NVR-STU/1NVR-STU_decoys.pdbqt | data/1N/1NVR-STU/1NVR-STU_decoy_scores.csv |
1N2X-SAM | data/1N/1N2X-SAM/1N2X-SAM_ligand.pdbqt | data/1N/1N2X-SAM/1N2X-SAM_target.pdbqt | data/1N/1N2X-SAM/1N2X-SAM_decoys.pdbqt | data/1N/1N2X-SAM/1N2X-SAM_decoy_scores.csv |
1NHG-TCL | data/1N/1NHG-TCL/1NHG-TCL_ligand.pdbqt | data/1N/1NHG-TCL/1NHG-TCL_target.pdbqt | data/1N/1NHG-TCL/1NHG-TCL_decoys.pdbqt | data/1N/1NHG-TCL/1NHG-TCL_decoy_scores.csv |
1N0X-CXS | data/1N/1N0X-CXS/1N0X-CXS_ligand.pdbqt | data/1N/1N0X-CXS/1N0X-CXS_target.pdbqt | data/1N/1N0X-CXS/1N0X-CXS_decoys.pdbqt | data/1N/1N0X-CXS/1N0X-CXS_decoy_scores.csv |
1NW5-SAM | data/1N/1NW5-SAM/1NW5-SAM_ligand.pdbqt | data/1N/1NW5-SAM/1NW5-SAM_target.pdbqt | data/1N/1NW5-SAM/1NW5-SAM_decoys.pdbqt | data/1N/1NW5-SAM/1NW5-SAM_decoy_scores.csv |
1N3O-GYP | data/1N/1N3O-GYP/1N3O-GYP_ligand.pdbqt | data/1N/1N3O-GYP/1N3O-GYP_target.pdbqt | data/1N/1N3O-GYP/1N3O-GYP_decoys.pdbqt | data/1N/1N3O-GYP/1N3O-GYP_decoy_scores.csv |
1NSS-BGC | data/1N/1NSS-BGC/1NSS-BGC_ligand.pdbqt | data/1N/1NSS-BGC/1NSS-BGC_target.pdbqt | data/1N/1NSS-BGC/1NSS-BGC_decoys.pdbqt | data/1N/1NSS-BGC/1NSS-BGC_decoy_scores.csv |
1N2G-APC | data/1N/1N2G-APC/1N2G-APC_ligand.pdbqt | data/1N/1N2G-APC/1N2G-APC_target.pdbqt | data/1N/1N2G-APC/1N2G-APC_decoys.pdbqt | data/1N/1N2G-APC/1N2G-APC_decoy_scores.csv |
1NAH-UDP | data/1N/1NAH-UDP/1NAH-UDP_ligand.pdbqt | data/1N/1NAH-UDP/1NAH-UDP_target.pdbqt | data/1N/1NAH-UDP/1NAH-UDP_decoys.pdbqt | data/1N/1NAH-UDP/1NAH-UDP_decoy_scores.csv |
1N4H-REA | data/1N/1N4H-REA/1N4H-REA_ligand.pdbqt | data/1N/1N4H-REA/1N4H-REA_target.pdbqt | data/1N/1N4H-REA/1N4H-REA_decoys.pdbqt | data/1N/1N4H-REA/1N4H-REA_decoy_scores.csv |
1N5I-ATP | data/1N/1N5I-ATP/1N5I-ATP_ligand.pdbqt | data/1N/1N5I-ATP/1N5I-ATP_target.pdbqt | data/1N/1N5I-ATP/1N5I-ATP_decoys.pdbqt | data/1N/1N5I-ATP/1N5I-ATP_decoy_scores.csv |
1NSD-DAN | data/1N/1NSD-DAN/1NSD-DAN_ligand.pdbqt | data/1N/1NSD-DAN/1NSD-DAN_target.pdbqt | data/1N/1NSD-DAN/1NSD-DAN_decoys.pdbqt | data/1N/1NSD-DAN/1NSD-DAN_decoy_scores.csv |
1NF0-13P | data/1N/1NF0-13P/1NF0-13P_ligand.pdbqt | data/1N/1NF0-13P/1NF0-13P_target.pdbqt | data/1N/1NF0-13P/1NF0-13P_decoys.pdbqt | data/1N/1NF0-13P/1NF0-13P_decoy_scores.csv |
1NA0-IPT | data/1N/1NA0-IPT/1NA0-IPT_ligand.pdbqt | data/1N/1NA0-IPT/1NA0-IPT_target.pdbqt | null | null |
1NUX-F6P | data/1N/1NUX-F6P/1NUX-F6P_ligand.pdbqt | data/1N/1NUX-F6P/1NUX-F6P_target.pdbqt | data/1N/1NUX-F6P/1NUX-F6P_decoys.pdbqt | data/1N/1NUX-F6P/1NUX-F6P_decoy_scores.csv |
1NSU-GLA | data/1N/1NSU-GLA/1NSU-GLA_ligand.pdbqt | data/1N/1NSU-GLA/1NSU-GLA_target.pdbqt | data/1N/1NSU-GLA/1NSU-GLA_decoys.pdbqt | data/1N/1NSU-GLA/1NSU-GLA_decoy_scores.csv |
1NR5-NAD | data/1N/1NR5-NAD/1NR5-NAD_ligand.pdbqt | data/1N/1NR5-NAD/1NR5-NAD_target.pdbqt | data/1N/1NR5-NAD/1NR5-NAD_decoys.pdbqt | data/1N/1NR5-NAD/1NR5-NAD_decoy_scores.csv |
1NV8-SAM | data/1N/1NV8-SAM/1NV8-SAM_ligand.pdbqt | data/1N/1NV8-SAM/1NV8-SAM_target.pdbqt | data/1N/1NV8-SAM/1NV8-SAM_decoys.pdbqt | data/1N/1NV8-SAM/1NV8-SAM_decoy_scores.csv |
1NUS-APC | data/1N/1NUS-APC/1NUS-APC_ligand.pdbqt | data/1N/1NUS-APC/1NUS-APC_target.pdbqt | data/1N/1NUS-APC/1NUS-APC_decoys.pdbqt | data/1N/1NUS-APC/1NUS-APC_decoy_scores.csv |
1N8U-BDD | data/1N/1N8U-BDD/1N8U-BDD_ligand.pdbqt | data/1N/1N8U-BDD/1N8U-BDD_target.pdbqt | data/1N/1N8U-BDD/1N8U-BDD_decoys.pdbqt | data/1N/1N8U-BDD/1N8U-BDD_decoy_scores.csv |
1NJR-XYL | data/1N/1NJR-XYL/1NJR-XYL_ligand.pdbqt | data/1N/1NJR-XYL/1NJR-XYL_target.pdbqt | data/1N/1NJR-XYL/1NJR-XYL_decoys.pdbqt | data/1N/1NJR-XYL/1NJR-XYL_decoy_scores.csv |
1NQ5-NAD | data/1N/1NQ5-NAD/1NQ5-NAD_ligand.pdbqt | data/1N/1NQ5-NAD/1NQ5-NAD_target.pdbqt | data/1N/1NQ5-NAD/1NQ5-NAD_decoys.pdbqt | data/1N/1NQ5-NAD/1NQ5-NAD_decoy_scores.csv |
1NDP-ADP | data/1N/1NDP-ADP/1NDP-ADP_ligand.pdbqt | data/1N/1NDP-ADP/1NDP-ADP_target.pdbqt | data/1N/1NDP-ADP/1NDP-ADP_decoys.pdbqt | data/1N/1NDP-ADP/1NDP-ADP_decoy_scores.csv |
1NUY-F6P | data/1N/1NUY-F6P/1NUY-F6P_ligand.pdbqt | data/1N/1NUY-F6P/1NUY-F6P_target.pdbqt | data/1N/1NUY-F6P/1NUY-F6P_decoys.pdbqt | data/1N/1NUY-F6P/1NUY-F6P_decoy_scores.csv |
1NQV-LMZ | data/1N/1NQV-LMZ/1NQV-LMZ_ligand.pdbqt | data/1N/1NQV-LMZ/1NQV-LMZ_target.pdbqt | data/1N/1NQV-LMZ/1NQV-LMZ_decoys.pdbqt | data/1N/1NQV-LMZ/1NQV-LMZ_decoy_scores.csv |
1N07-ADP | data/1N/1N07-ADP/1N07-ADP_ligand.pdbqt | data/1N/1N07-ADP/1N07-ADP_target.pdbqt | data/1N/1N07-ADP/1N07-ADP_decoys.pdbqt | data/1N/1N07-ADP/1N07-ADP_decoy_scores.csv |
1NQ0-4HY | data/1N/1NQ0-4HY/1NQ0-4HY_ligand.pdbqt | data/1N/1NQ0-4HY/1NQ0-4HY_target.pdbqt | null | null |
1NAH-NAD | data/1N/1NAH-NAD/1NAH-NAD_ligand.pdbqt | data/1N/1NAH-NAD/1NAH-NAD_target.pdbqt | data/1N/1NAH-NAD/1NAH-NAD_decoys.pdbqt | data/1N/1NAH-NAD/1NAH-NAD_decoy_scores.csv |
1NVQ-UCN | data/1N/1NVQ-UCN/1NVQ-UCN_ligand.pdbqt | data/1N/1NVQ-UCN/1NVQ-UCN_target.pdbqt | data/1N/1NVQ-UCN/1NVQ-UCN_decoys.pdbqt | data/1N/1NVQ-UCN/1NVQ-UCN_decoy_scores.csv |
1NZD-UPG | data/1N/1NZD-UPG/1NZD-UPG_ligand.pdbqt | data/1N/1NZD-UPG/1NZD-UPG_target.pdbqt | data/1N/1NZD-UPG/1NZD-UPG_decoys.pdbqt | data/1N/1NZD-UPG/1NZD-UPG_decoy_scores.csv |
1NOX-FMN | data/1N/1NOX-FMN/1NOX-FMN_ligand.pdbqt | data/1N/1NOX-FMN/1NOX-FMN_target.pdbqt | data/1N/1NOX-FMN/1NOX-FMN_decoys.pdbqt | data/1N/1NOX-FMN/1NOX-FMN_decoy_scores.csv |
1NF8-ISC | data/1N/1NF8-ISC/1NF8-ISC_ligand.pdbqt | data/1N/1NF8-ISC/1NF8-ISC_target.pdbqt | data/1N/1NF8-ISC/1NF8-ISC_decoys.pdbqt | data/1N/1NF8-ISC/1NF8-ISC_decoy_scores.csv |
1NGC-ADP | data/1N/1NGC-ADP/1NGC-ADP_ligand.pdbqt | data/1N/1NGC-ADP/1NGC-ADP_target.pdbqt | data/1N/1NGC-ADP/1NGC-ADP_decoys.pdbqt | data/1N/1NGC-ADP/1NGC-ADP_decoy_scores.csv |
1NB9-ADP | data/1N/1NB9-ADP/1NB9-ADP_ligand.pdbqt | data/1N/1NB9-ADP/1NB9-ADP_target.pdbqt | data/1N/1NB9-ADP/1NB9-ADP_decoys.pdbqt | data/1N/1NB9-ADP/1NB9-ADP_decoy_scores.csv |
1N4Q-MGM | data/1N/1N4Q-MGM/1N4Q-MGM_ligand.pdbqt | data/1N/1N4Q-MGM/1N4Q-MGM_target.pdbqt | data/1N/1N4Q-MGM/1N4Q-MGM_decoys.pdbqt | data/1N/1N4Q-MGM/1N4Q-MGM_decoy_scores.csv |
1NCE-UMP | data/1N/1NCE-UMP/1NCE-UMP_ligand.pdbqt | data/1N/1NCE-UMP/1NCE-UMP_target.pdbqt | data/1N/1NCE-UMP/1NCE-UMP_decoys.pdbqt | data/1N/1NCE-UMP/1NCE-UMP_decoy_scores.csv |
1NUQ-DND | data/1N/1NUQ-DND/1NUQ-DND_ligand.pdbqt | data/1N/1NUQ-DND/1NUQ-DND_target.pdbqt | data/1N/1NUQ-DND/1NUQ-DND_decoys.pdbqt | data/1N/1NUQ-DND/1NUQ-DND_decoy_scores.csv |
1NJD-UMP | data/1N/1NJD-UMP/1NJD-UMP_ligand.pdbqt | data/1N/1NJD-UMP/1NJD-UMP_target.pdbqt | data/1N/1NJD-UMP/1NJD-UMP_decoys.pdbqt | data/1N/1NJD-UMP/1NJD-UMP_decoy_scores.csv |
1N23-2BN | data/1N/1N23-2BN/1N23-2BN_ligand.pdbqt | data/1N/1N23-2BN/1N23-2BN_target.pdbqt | data/1N/1N23-2BN/1N23-2BN_decoys.pdbqt | data/1N/1N23-2BN/1N23-2BN_decoy_scores.csv |
1NOK-NTZ | data/1N/1NOK-NTZ/1NOK-NTZ_ligand.pdbqt | data/1N/1NOK-NTZ/1NOK-NTZ_target.pdbqt | data/1N/1NOK-NTZ/1NOK-NTZ_decoys.pdbqt | data/1N/1NOK-NTZ/1NOK-NTZ_decoy_scores.csv |
1NPA-3NH | data/1N/1NPA-3NH/1NPA-3NH_ligand.pdbqt | data/1N/1NPA-3NH/1NPA-3NH_target.pdbqt | data/1N/1NPA-3NH/1NPA-3NH_decoys.pdbqt | data/1N/1NPA-3NH/1NPA-3NH_decoy_scores.csv |
1NNK-CE2 | data/1N/1NNK-CE2/1NNK-CE2_ligand.pdbqt | data/1N/1NNK-CE2/1NNK-CE2_target.pdbqt | data/1N/1NNK-CE2/1NNK-CE2_decoys.pdbqt | data/1N/1NNK-CE2/1NNK-CE2_decoy_scores.csv |
1NH8-AMP | data/1N/1NH8-AMP/1NH8-AMP_ligand.pdbqt | data/1N/1NH8-AMP/1NH8-AMP_target.pdbqt | data/1N/1NH8-AMP/1NH8-AMP_decoys.pdbqt | data/1N/1NH8-AMP/1NH8-AMP_decoy_scores.csv |
1N5L-TMP | data/1N/1N5L-TMP/1N5L-TMP_ligand.pdbqt | data/1N/1N5L-TMP/1N5L-TMP_target.pdbqt | data/1N/1N5L-TMP/1N5L-TMP_decoys.pdbqt | data/1N/1N5L-TMP/1N5L-TMP_decoy_scores.csv |
1N4K-I3P | data/1N/1N4K-I3P/1N4K-I3P_ligand.pdbqt | data/1N/1N4K-I3P/1N4K-I3P_target.pdbqt | data/1N/1N4K-I3P/1N4K-I3P_decoys.pdbqt | data/1N/1N4K-I3P/1N4K-I3P_decoy_scores.csv |
1NE4-RP1 | data/1N/1NE4-RP1/1NE4-RP1_ligand.pdbqt | data/1N/1NE4-RP1/1NE4-RP1_target.pdbqt | data/1N/1NE4-RP1/1NE4-RP1_decoys.pdbqt | data/1N/1NE4-RP1/1NE4-RP1_decoy_scores.csv |
1NFX-RDR | data/1N/1NFX-RDR/1NFX-RDR_ligand.pdbqt | data/1N/1NFX-RDR/1NFX-RDR_target.pdbqt | data/1N/1NFX-RDR/1NFX-RDR_decoys.pdbqt | data/1N/1NFX-RDR/1NFX-RDR_decoy_scores.csv |
1NHK-CMP | data/1N/1NHK-CMP/1NHK-CMP_ligand.pdbqt | data/1N/1NHK-CMP/1NHK-CMP_target.pdbqt | data/1N/1NHK-CMP/1NHK-CMP_decoys.pdbqt | data/1N/1NHK-CMP/1NHK-CMP_decoy_scores.csv |
1NU2-I3P | data/1N/1NU2-I3P/1NU2-I3P_ligand.pdbqt | data/1N/1NU2-I3P/1NU2-I3P_target.pdbqt | data/1N/1NU2-I3P/1NU2-I3P_decoys.pdbqt | data/1N/1NU2-I3P/1NU2-I3P_decoy_scores.csv |
1NHI-ANP | data/1N/1NHI-ANP/1NHI-ANP_ligand.pdbqt | data/1N/1NHI-ANP/1NHI-ANP_target.pdbqt | data/1N/1NHI-ANP/1NHI-ANP_decoys.pdbqt | data/1N/1NHI-ANP/1NHI-ANP_decoy_scores.csv |
1NT1-T76 | data/1N/1NT1-T76/1NT1-T76_ligand.pdbqt | data/1N/1NT1-T76/1NT1-T76_target.pdbqt | data/1N/1NT1-T76/1NT1-T76_decoys.pdbqt | data/1N/1NT1-T76/1NT1-T76_decoy_scores.csv |
1NZC-TDX | data/1N/1NZC-TDX/1NZC-TDX_ligand.pdbqt | data/1N/1NZC-TDX/1NZC-TDX_target.pdbqt | data/1N/1NZC-TDX/1NZC-TDX_decoys.pdbqt | data/1N/1NZC-TDX/1NZC-TDX_decoy_scores.csv |
1NSY-ATP | data/1N/1NSY-ATP/1NSY-ATP_ligand.pdbqt | data/1N/1NSY-ATP/1NSY-ATP_target.pdbqt | data/1N/1NSY-ATP/1NSY-ATP_decoys.pdbqt | data/1N/1NSY-ATP/1NSY-ATP_decoy_scores.csv |
1N1I-HIS | data/1N/1N1I-HIS/1N1I-HIS_ligand.pdbqt | data/1N/1N1I-HIS/1N1I-HIS_target.pdbqt | data/1N/1N1I-HIS/1N1I-HIS_decoys.pdbqt | data/1N/1N1I-HIS/1N1I-HIS_decoy_scores.csv |
1NVU-GTP | data/1N/1NVU-GTP/1NVU-GTP_ligand.pdbqt | data/1N/1NVU-GTP/1NVU-GTP_target.pdbqt | data/1N/1NVU-GTP/1NVU-GTP_decoys.pdbqt | data/1N/1NVU-GTP/1NVU-GTP_decoy_scores.csv |
1NC6-ABB | data/1N/1NC6-ABB/1NC6-ABB_ligand.pdbqt | data/1N/1NC6-ABB/1NC6-ABB_target.pdbqt | data/1N/1NC6-ABB/1NC6-ABB_decoys.pdbqt | data/1N/1NC6-ABB/1NC6-ABB_decoy_scores.csv |
1NW6-SFG | data/1N/1NW6-SFG/1NW6-SFG_ligand.pdbqt | data/1N/1NW6-SFG/1NW6-SFG_target.pdbqt | data/1N/1NW6-SFG/1NW6-SFG_decoys.pdbqt | data/1N/1NW6-SFG/1NW6-SFG_decoy_scores.csv |
1NUZ-F6P | data/1N/1NUZ-F6P/1NUZ-F6P_ligand.pdbqt | data/1N/1NUZ-F6P/1NUZ-F6P_target.pdbqt | data/1N/1NUZ-F6P/1NUZ-F6P_decoys.pdbqt | data/1N/1NUZ-F6P/1NUZ-F6P_decoy_scores.csv |
1NHJ-ANP | data/1N/1NHJ-ANP/1NHJ-ANP_ligand.pdbqt | data/1N/1NHJ-ANP/1NHJ-ANP_target.pdbqt | data/1N/1NHJ-ANP/1NHJ-ANP_decoys.pdbqt | data/1N/1NHJ-ANP/1NHJ-ANP_decoy_scores.csv |
1NGH-ATP | data/1N/1NGH-ATP/1NGH-ATP_ligand.pdbqt | data/1N/1NGH-ATP/1NGH-ATP_target.pdbqt | data/1N/1NGH-ATP/1NGH-ATP_decoys.pdbqt | data/1N/1NGH-ATP/1NGH-ATP_decoy_scores.csv |
1NPV-L27 | data/1N/1NPV-L27/1NPV-L27_ligand.pdbqt | data/1N/1NPV-L27/1NPV-L27_target.pdbqt | data/1N/1NPV-L27/1NPV-L27_decoys.pdbqt | data/1N/1NPV-L27/1NPV-L27_decoy_scores.csv |
1NNI-FMN | data/1N/1NNI-FMN/1NNI-FMN_ligand.pdbqt | data/1N/1NNI-FMN/1NNI-FMN_target.pdbqt | data/1N/1NNI-FMN/1NNI-FMN_decoys.pdbqt | data/1N/1NNI-FMN/1NNI-FMN_decoy_scores.csv |
1NDW-FR2 | data/1N/1NDW-FR2/1NDW-FR2_ligand.pdbqt | data/1N/1NDW-FR2/1NDW-FR2_target.pdbqt | data/1N/1NDW-FR2/1NDW-FR2_decoys.pdbqt | data/1N/1NDW-FR2/1NDW-FR2_decoy_scores.csv |
1NMZ-ANP | data/1N/1NMZ-ANP/1NMZ-ANP_ligand.pdbqt | data/1N/1NMZ-ANP/1NMZ-ANP_target.pdbqt | data/1N/1NMZ-ANP/1NMZ-ANP_decoys.pdbqt | data/1N/1NMZ-ANP/1NMZ-ANP_decoy_scores.csv |
1NHW-TCC | data/1N/1NHW-TCC/1NHW-TCC_ligand.pdbqt | data/1N/1NHW-TCC/1NHW-TCC_target.pdbqt | data/1N/1NHW-TCC/1NHW-TCC_decoys.pdbqt | data/1N/1NHW-TCC/1NHW-TCC_decoy_scores.csv |
1NUU-NAD | data/1N/1NUU-NAD/1NUU-NAD_ligand.pdbqt | data/1N/1NUU-NAD/1NUU-NAD_target.pdbqt | data/1N/1NUU-NAD/1NUU-NAD_decoys.pdbqt | data/1N/1NUU-NAD/1NUU-NAD_decoy_scores.csv |
1N2B-APC | data/1N/1N2B-APC/1N2B-APC_ligand.pdbqt | data/1N/1N2B-APC/1N2B-APC_target.pdbqt | data/1N/1N2B-APC/1N2B-APC_decoys.pdbqt | data/1N/1N2B-APC/1N2B-APC_decoy_scores.csv |
1NN5-2DT | data/1N/1NN5-2DT/1NN5-2DT_ligand.pdbqt | data/1N/1NN5-2DT/1NN5-2DT_target.pdbqt | data/1N/1NN5-2DT/1NN5-2DT_decoys.pdbqt | data/1N/1NN5-2DT/1NN5-2DT_decoy_scores.csv |
1NGG-ATP | data/1N/1NGG-ATP/1NGG-ATP_ligand.pdbqt | data/1N/1NGG-ATP/1NGG-ATP_target.pdbqt | data/1N/1NGG-ATP/1NGG-ATP_decoys.pdbqt | data/1N/1NGG-ATP/1NGG-ATP_decoy_scores.csv |
1N0S-FLU | data/1N/1N0S-FLU/1N0S-FLU_ligand.pdbqt | data/1N/1N0S-FLU/1N0S-FLU_target.pdbqt | data/1N/1N0S-FLU/1N0S-FLU_decoys.pdbqt | data/1N/1N0S-FLU/1N0S-FLU_decoy_scores.csv |
1NN5-ANP | data/1N/1NN5-ANP/1NN5-ANP_ligand.pdbqt | data/1N/1NN5-ANP/1NN5-ANP_target.pdbqt | data/1N/1NN5-ANP/1NN5-ANP_decoys.pdbqt | data/1N/1NN5-ANP/1NN5-ANP_decoy_scores.csv |
1NHU-153 | data/1N/1NHU-153/1NHU-153_ligand.pdbqt | data/1N/1NHU-153/1NHU-153_target.pdbqt | data/1N/1NHU-153/1NHU-153_decoys.pdbqt | data/1N/1NHU-153/1NHU-153_decoy_scores.csv |
1NVK-UDP | data/1N/1NVK-UDP/1NVK-UDP_ligand.pdbqt | data/1N/1NVK-UDP/1NVK-UDP_target.pdbqt | data/1N/1NVK-UDP/1NVK-UDP_decoys.pdbqt | data/1N/1NVK-UDP/1NVK-UDP_decoy_scores.csv |
1NSM-GLA | data/1N/1NSM-GLA/1NSM-GLA_ligand.pdbqt | data/1N/1NSM-GLA/1NSM-GLA_target.pdbqt | data/1N/1NSM-GLA/1NSM-GLA_decoys.pdbqt | data/1N/1NSM-GLA/1NSM-GLA_decoy_scores.csv |
1NN0-ADP | data/1N/1NN0-ADP/1NN0-ADP_ligand.pdbqt | data/1N/1NN0-ADP/1NN0-ADP_target.pdbqt | data/1N/1NN0-ADP/1NN0-ADP_decoys.pdbqt | data/1N/1NN0-ADP/1NN0-ADP_decoy_scores.csv |
1NGF-ATP | data/1N/1NGF-ATP/1NGF-ATP_ligand.pdbqt | data/1N/1NGF-ATP/1NGF-ATP_target.pdbqt | data/1N/1NGF-ATP/1NGF-ATP_decoys.pdbqt | data/1N/1NGF-ATP/1NGF-ATP_decoy_scores.csv |
1N61-MCN | data/1N/1N61-MCN/1N61-MCN_ligand.pdbqt | data/1N/1N61-MCN/1N61-MCN_target.pdbqt | null | null |
1N9M-BTN | data/1N/1N9M-BTN/1N9M-BTN_ligand.pdbqt | data/1N/1N9M-BTN/1N9M-BTN_target.pdbqt | data/1N/1N9M-BTN/1N9M-BTN_decoys.pdbqt | data/1N/1N9M-BTN/1N9M-BTN_decoy_scores.csv |
1N06-ADP | data/1N/1N06-ADP/1N06-ADP_ligand.pdbqt | data/1N/1N06-ADP/1N06-ADP_target.pdbqt | data/1N/1N06-ADP/1N06-ADP_decoys.pdbqt | data/1N/1N06-ADP/1N06-ADP_decoy_scores.csv |
1CG0-GDP | data/1C/1CG0-GDP/1CG0-GDP_ligand.pdbqt | data/1C/1CG0-GDP/1CG0-GDP_target.pdbqt | data/1C/1CG0-GDP/1CG0-GDP_decoys.pdbqt | data/1C/1CG0-GDP/1CG0-GDP_decoy_scores.csv |
1CS1-DHD | data/1C/1CS1-DHD/1CS1-DHD_ligand.pdbqt | data/1C/1CS1-DHD/1CS1-DHD_target.pdbqt | data/1C/1CS1-DHD/1CS1-DHD_decoys.pdbqt | data/1C/1CS1-DHD/1CS1-DHD_decoy_scores.csv |
Subsets and Splits
No community queries yet
The top public SQL queries from the community will appear here once available.