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 ⌀ |
|---|---|---|---|---|
1NGI-ANP | data/1N/1NGI-ANP/1NGI-ANP_ligand.pdbqt | data/1N/1NGI-ANP/1NGI-ANP_target.pdbqt | data/1N/1NGI-ANP/1NGI-ANP_decoys.pdbqt | data/1N/1NGI-ANP/1NGI-ANP_decoy_scores.csv |
1NG1-GDP | data/1N/1NG1-GDP/1NG1-GDP_ligand.pdbqt | data/1N/1NG1-GDP/1NG1-GDP_target.pdbqt | data/1N/1NG1-GDP/1NG1-GDP_decoys.pdbqt | data/1N/1NG1-GDP/1NG1-GDP_decoy_scores.csv |
1N5J-TYD | data/1N/1N5J-TYD/1N5J-TYD_ligand.pdbqt | data/1N/1N5J-TYD/1N5J-TYD_target.pdbqt | data/1N/1N5J-TYD/1N5J-TYD_decoys.pdbqt | data/1N/1N5J-TYD/1N5J-TYD_decoy_scores.csv |
1NE6-SP1 | data/1N/1NE6-SP1/1NE6-SP1_ligand.pdbqt | data/1N/1NE6-SP1/1NE6-SP1_target.pdbqt | data/1N/1NE6-SP1/1NE6-SP1_decoys.pdbqt | data/1N/1NE6-SP1/1NE6-SP1_decoy_scores.csv |
1NV9-SAH | data/1N/1NV9-SAH/1NV9-SAH_ligand.pdbqt | data/1N/1NV9-SAH/1NV9-SAH_target.pdbqt | data/1N/1NV9-SAH/1NV9-SAH_decoys.pdbqt | data/1N/1NV9-SAH/1NV9-SAH_decoy_scores.csv |
1NGS-E4P | data/1N/1NGS-E4P/1NGS-E4P_ligand.pdbqt | data/1N/1NGS-E4P/1NGS-E4P_target.pdbqt | data/1N/1NGS-E4P/1NGS-E4P_decoys.pdbqt | data/1N/1NGS-E4P/1NGS-E4P_decoy_scores.csv |
1N5L-TYD | data/1N/1N5L-TYD/1N5L-TYD_ligand.pdbqt | data/1N/1N5L-TYD/1N5L-TYD_target.pdbqt | data/1N/1N5L-TYD/1N5L-TYD_decoys.pdbqt | data/1N/1N5L-TYD/1N5L-TYD_decoy_scores.csv |
1NWK-ANP | data/1N/1NWK-ANP/1NWK-ANP_ligand.pdbqt | data/1N/1NWK-ANP/1NWK-ANP_target.pdbqt | data/1N/1NWK-ANP/1NWK-ANP_decoys.pdbqt | data/1N/1NWK-ANP/1NWK-ANP_decoy_scores.csv |
1NHX-PEP | data/1N/1NHX-PEP/1NHX-PEP_ligand.pdbqt | data/1N/1NHX-PEP/1NHX-PEP_target.pdbqt | data/1N/1NHX-PEP/1NHX-PEP_decoys.pdbqt | data/1N/1NHX-PEP/1NHX-PEP_decoy_scores.csv |
1NU3-VPR | data/1N/1NU3-VPR/1NU3-VPR_ligand.pdbqt | data/1N/1NU3-VPR/1NU3-VPR_target.pdbqt | data/1N/1NU3-VPR/1NU3-VPR_decoys.pdbqt | data/1N/1NU3-VPR/1NU3-VPR_decoy_scores.csv |
1NAV-IH5 | data/1N/1NAV-IH5/1NAV-IH5_ligand.pdbqt | data/1N/1NAV-IH5/1NAV-IH5_target.pdbqt | data/1N/1NAV-IH5/1NAV-IH5_decoys.pdbqt | data/1N/1NAV-IH5/1NAV-IH5_decoy_scores.csv |
1NZ7-901 | data/1N/1NZ7-901/1NZ7-901_ligand.pdbqt | data/1N/1NZ7-901/1NZ7-901_target.pdbqt | data/1N/1NZ7-901/1NZ7-901_decoys.pdbqt | data/1N/1NZ7-901/1NZ7-901_decoy_scores.csv |
1NSA-BEN | data/1N/1NSA-BEN/1NSA-BEN_ligand.pdbqt | data/1N/1NSA-BEN/1NSA-BEN_target.pdbqt | data/1N/1NSA-BEN/1NSA-BEN_decoys.pdbqt | data/1N/1NSA-BEN/1NSA-BEN_decoy_scores.csv |
1N2E-PAF | data/1N/1N2E-PAF/1N2E-PAF_ligand.pdbqt | data/1N/1N2E-PAF/1N2E-PAF_target.pdbqt | data/1N/1N2E-PAF/1N2E-PAF_decoys.pdbqt | data/1N/1N2E-PAF/1N2E-PAF_decoy_scores.csv |
1NV7-AMP | data/1N/1NV7-AMP/1NV7-AMP_ligand.pdbqt | data/1N/1NV7-AMP/1NV7-AMP_target.pdbqt | null | null |
1NXG-NAI | data/1N/1NXG-NAI/1NXG-NAI_ligand.pdbqt | data/1N/1NXG-NAI/1NXG-NAI_target.pdbqt | data/1N/1NXG-NAI/1NXG-NAI_decoys.pdbqt | data/1N/1NXG-NAI/1NXG-NAI_decoy_scores.csv |
1NGA-ADP | data/1N/1NGA-ADP/1NGA-ADP_ligand.pdbqt | data/1N/1NGA-ADP/1NGA-ADP_target.pdbqt | data/1N/1NGA-ADP/1NGA-ADP_decoys.pdbqt | data/1N/1NGA-ADP/1NGA-ADP_decoy_scores.csv |
1N08-ADP | data/1N/1N08-ADP/1N08-ADP_ligand.pdbqt | data/1N/1N08-ADP/1N08-ADP_target.pdbqt | data/1N/1N08-ADP/1N08-ADP_decoys.pdbqt | data/1N/1N08-ADP/1N08-ADP_decoy_scores.csv |
1NO3-4NC | data/1N/1NO3-4NC/1NO3-4NC_ligand.pdbqt | data/1N/1NO3-4NC/1NO3-4NC_target.pdbqt | data/1N/1NO3-4NC/1NO3-4NC_decoys.pdbqt | data/1N/1NO3-4NC/1NO3-4NC_decoy_scores.csv |
1N2N-ARG | data/1N/1N2N-ARG/1N2N-ARG_ligand.pdbqt | data/1N/1N2N-ARG/1N2N-ARG_target.pdbqt | data/1N/1N2N-ARG/1N2N-ARG_decoys.pdbqt | data/1N/1N2N-ARG/1N2N-ARG_decoy_scores.csv |
1NNF-EDT | data/1N/1NNF-EDT/1NNF-EDT_ligand.pdbqt | data/1N/1NNF-EDT/1NNF-EDT_target.pdbqt | data/1N/1NNF-EDT/1NNF-EDT_decoys.pdbqt | data/1N/1NNF-EDT/1NNF-EDT_decoy_scores.csv |
1N1V-DAN | data/1N/1N1V-DAN/1N1V-DAN_ligand.pdbqt | data/1N/1N1V-DAN/1N1V-DAN_target.pdbqt | data/1N/1N1V-DAN/1N1V-DAN_decoys.pdbqt | data/1N/1N1V-DAN/1N1V-DAN_decoy_scores.csv |
1NF3-GNP | data/1N/1NF3-GNP/1NF3-GNP_ligand.pdbqt | data/1N/1NF3-GNP/1NF3-GNP_target.pdbqt | data/1N/1NF3-GNP/1NF3-GNP_decoys.pdbqt | data/1N/1NF3-GNP/1NF3-GNP_decoy_scores.csv |
1NKZ-BEN | data/1N/1NKZ-BEN/1NKZ-BEN_ligand.pdbqt | data/1N/1NKZ-BEN/1NKZ-BEN_target.pdbqt | data/1N/1NKZ-BEN/1NKZ-BEN_decoys.pdbqt | data/1N/1NKZ-BEN/1NKZ-BEN_decoy_scores.csv |
1N0U-SO1 | data/1N/1N0U-SO1/1N0U-SO1_ligand.pdbqt | data/1N/1N0U-SO1/1N0U-SO1_target.pdbqt | data/1N/1N0U-SO1/1N0U-SO1_decoys.pdbqt | data/1N/1N0U-SO1/1N0U-SO1_decoy_scores.csv |
1N1G-PLM | data/1N/1N1G-PLM/1N1G-PLM_ligand.pdbqt | data/1N/1N1G-PLM/1N1G-PLM_target.pdbqt | data/1N/1N1G-PLM/1N1G-PLM_decoys.pdbqt | data/1N/1N1G-PLM/1N1G-PLM_decoy_scores.csv |
1NX9-AIC | data/1N/1NX9-AIC/1NX9-AIC_ligand.pdbqt | data/1N/1NX9-AIC/1NX9-AIC_target.pdbqt | data/1N/1NX9-AIC/1NX9-AIC_decoys.pdbqt | data/1N/1NX9-AIC/1NX9-AIC_decoy_scores.csv |
1N83-CLR | data/1N/1N83-CLR/1N83-CLR_ligand.pdbqt | data/1N/1N83-CLR/1N83-CLR_target.pdbqt | data/1N/1N83-CLR/1N83-CLR_decoys.pdbqt | data/1N/1N83-CLR/1N83-CLR_decoy_scores.csv |
1N6A-SAM | data/1N/1N6A-SAM/1N6A-SAM_ligand.pdbqt | data/1N/1N6A-SAM/1N6A-SAM_target.pdbqt | data/1N/1N6A-SAM/1N6A-SAM_decoys.pdbqt | data/1N/1N6A-SAM/1N6A-SAM_decoy_scores.csv |
1N92-NAJ | data/1N/1N92-NAJ/1N92-NAJ_ligand.pdbqt | data/1N/1N92-NAJ/1N92-NAJ_target.pdbqt | data/1N/1N92-NAJ/1N92-NAJ_decoys.pdbqt | data/1N/1N92-NAJ/1N92-NAJ_decoy_scores.csv |
1N95-FTH | data/1N/1N95-FTH/1N95-FTH_ligand.pdbqt | data/1N/1N95-FTH/1N95-FTH_target.pdbqt | data/1N/1N95-FTH/1N95-FTH_decoys.pdbqt | data/1N/1N95-FTH/1N95-FTH_decoy_scores.csv |
1NX3-ISA | data/1N/1NX3-ISA/1NX3-ISA_ligand.pdbqt | data/1N/1NX3-ISA/1NX3-ISA_target.pdbqt | data/1N/1NX3-ISA/1NX3-ISA_decoys.pdbqt | data/1N/1NX3-ISA/1NX3-ISA_decoy_scores.csv |
1N6M-ADP | data/1N/1N6M-ADP/1N6M-ADP_ligand.pdbqt | data/1N/1N6M-ADP/1N6M-ADP_target.pdbqt | data/1N/1N6M-ADP/1N6M-ADP_decoys.pdbqt | data/1N/1N6M-ADP/1N6M-ADP_decoy_scores.csv |
1NFR-NAD | data/1N/1NFR-NAD/1NFR-NAD_ligand.pdbqt | data/1N/1NFR-NAD/1NFR-NAD_target.pdbqt | data/1N/1NFR-NAD/1NFR-NAD_decoys.pdbqt | data/1N/1NFR-NAD/1NFR-NAD_decoy_scores.csv |
1NSZ-GLC | data/1N/1NSZ-GLC/1NSZ-GLC_ligand.pdbqt | data/1N/1NSZ-GLC/1NSZ-GLC_target.pdbqt | data/1N/1NSZ-GLC/1NSZ-GLC_decoys.pdbqt | data/1N/1NSZ-GLC/1NSZ-GLC_decoy_scores.csv |
1NM1-ATP | data/1N/1NM1-ATP/1NM1-ATP_ligand.pdbqt | data/1N/1NM1-ATP/1NM1-ATP_target.pdbqt | data/1N/1NM1-ATP/1NM1-ATP_decoys.pdbqt | data/1N/1NM1-ATP/1NM1-ATP_decoy_scores.csv |
1NSC-SIA | data/1N/1NSC-SIA/1NSC-SIA_ligand.pdbqt | data/1N/1NSC-SIA/1NSC-SIA_target.pdbqt | data/1N/1NSC-SIA/1NSC-SIA_decoys.pdbqt | data/1N/1NSC-SIA/1NSC-SIA_decoy_scores.csv |
1NW4-IMH | data/1N/1NW4-IMH/1NW4-IMH_ligand.pdbqt | data/1N/1NW4-IMH/1NW4-IMH_target.pdbqt | data/1N/1NW4-IMH/1NW4-IMH_decoys.pdbqt | data/1N/1NW4-IMH/1NW4-IMH_decoy_scores.csv |
1N3I-DIH | data/1N/1N3I-DIH/1N3I-DIH_ligand.pdbqt | data/1N/1N3I-DIH/1N3I-DIH_target.pdbqt | data/1N/1N3I-DIH/1N3I-DIH_decoys.pdbqt | data/1N/1N3I-DIH/1N3I-DIH_decoy_scores.csv |
1N2H-PAJ | data/1N/1N2H-PAJ/1N2H-PAJ_ligand.pdbqt | data/1N/1N2H-PAJ/1N2H-PAJ_target.pdbqt | data/1N/1N2H-PAJ/1N2H-PAJ_decoys.pdbqt | data/1N/1N2H-PAJ/1N2H-PAJ_decoy_scores.csv |
1NDF-152 | data/1N/1NDF-152/1NDF-152_ligand.pdbqt | data/1N/1NDF-152/1NDF-152_target.pdbqt | data/1N/1NDF-152/1NDF-152_decoys.pdbqt | data/1N/1NDF-152/1NDF-152_decoy_scores.csv |
1N9N-FMN | data/1N/1N9N-FMN/1N9N-FMN_ligand.pdbqt | data/1N/1N9N-FMN/1N9N-FMN_target.pdbqt | data/1N/1N9N-FMN/1N9N-FMN_decoys.pdbqt | data/1N/1N9N-FMN/1N9N-FMN_decoy_scores.csv |
1N75-ATP | data/1N/1N75-ATP/1N75-ATP_ligand.pdbqt | data/1N/1N75-ATP/1N75-ATP_target.pdbqt | data/1N/1N75-ATP/1N75-ATP_decoys.pdbqt | data/1N/1N75-ATP/1N75-ATP_decoy_scores.csv |
1NDV-FR0 | data/1N/1NDV-FR0/1NDV-FR0_ligand.pdbqt | data/1N/1NDV-FR0/1NDV-FR0_target.pdbqt | data/1N/1NDV-FR0/1NDV-FR0_decoys.pdbqt | data/1N/1NDV-FR0/1NDV-FR0_decoy_scores.csv |
1NJA-DCM | data/1N/1NJA-DCM/1NJA-DCM_ligand.pdbqt | data/1N/1NJA-DCM/1NJA-DCM_target.pdbqt | data/1N/1NJA-DCM/1NJA-DCM_decoys.pdbqt | data/1N/1NJA-DCM/1NJA-DCM_decoy_scores.csv |
1NSV-BGC | data/1N/1NSV-BGC/1NSV-BGC_ligand.pdbqt | data/1N/1NSV-BGC/1NSV-BGC_target.pdbqt | data/1N/1NSV-BGC/1NSV-BGC_decoys.pdbqt | data/1N/1NSV-BGC/1NSV-BGC_decoy_scores.csv |
1N6H-GNP | data/1N/1N6H-GNP/1N6H-GNP_ligand.pdbqt | data/1N/1N6H-GNP/1N6H-GNP_target.pdbqt | data/1N/1N6H-GNP/1N6H-GNP_decoys.pdbqt | data/1N/1N6H-GNP/1N6H-GNP_decoy_scores.csv |
1NZQ-162 | data/1N/1NZQ-162/1NZQ-162_ligand.pdbqt | data/1N/1NZQ-162/1NZQ-162_target.pdbqt | data/1N/1NZQ-162/1NZQ-162_decoys.pdbqt | data/1N/1NZQ-162/1NZQ-162_decoy_scores.csv |
1NR6-DIF | data/1N/1NR6-DIF/1NR6-DIF_ligand.pdbqt | data/1N/1NR6-DIF/1NR6-DIF_target.pdbqt | data/1N/1NR6-DIF/1NR6-DIF_decoys.pdbqt | data/1N/1NR6-DIF/1NR6-DIF_decoy_scores.csv |
1NGD-ADP | data/1N/1NGD-ADP/1NGD-ADP_ligand.pdbqt | data/1N/1NGD-ADP/1NGD-ADP_target.pdbqt | data/1N/1NGD-ADP/1NGD-ADP_decoys.pdbqt | data/1N/1NGD-ADP/1NGD-ADP_decoy_scores.csv |
1NOO-CAH | data/1N/1NOO-CAH/1NOO-CAH_ligand.pdbqt | data/1N/1NOO-CAH/1NOO-CAH_target.pdbqt | data/1N/1NOO-CAH/1NOO-CAH_decoys.pdbqt | data/1N/1NOO-CAH/1NOO-CAH_decoy_scores.csv |
1NQA-NAD | data/1N/1NQA-NAD/1NQA-NAD_ligand.pdbqt | data/1N/1NQA-NAD/1NQA-NAD_target.pdbqt | data/1N/1NQA-NAD/1NQA-NAD_decoys.pdbqt | data/1N/1NQA-NAD/1NQA-NAD_decoy_scores.csv |
1N1G-BCP | data/1N/1N1G-BCP/1N1G-BCP_ligand.pdbqt | data/1N/1N1G-BCP/1N1G-BCP_target.pdbqt | data/1N/1N1G-BCP/1N1G-BCP_decoys.pdbqt | data/1N/1N1G-BCP/1N1G-BCP_decoy_scores.csv |
1NN0-2DT | data/1N/1NN0-2DT/1NN0-2DT_ligand.pdbqt | data/1N/1NN0-2DT/1NN0-2DT_target.pdbqt | data/1N/1NN0-2DT/1NN0-2DT_decoys.pdbqt | data/1N/1NN0-2DT/1NN0-2DT_decoy_scores.csv |
1NLI-ADE | data/1N/1NLI-ADE/1NLI-ADE_ligand.pdbqt | data/1N/1NLI-ADE/1NLI-ADE_target.pdbqt | data/1N/1NLI-ADE/1NLI-ADE_decoys.pdbqt | data/1N/1NLI-ADE/1NLI-ADE_decoy_scores.csv |
1NN1-ANP | data/1N/1NN1-ANP/1NN1-ANP_ligand.pdbqt | data/1N/1NN1-ANP/1NN1-ANP_target.pdbqt | data/1N/1NN1-ANP/1NN1-ANP_decoys.pdbqt | data/1N/1NN1-ANP/1NN1-ANP_decoy_scores.csv |
1NC1-MTH | data/1N/1NC1-MTH/1NC1-MTH_ligand.pdbqt | data/1N/1NC1-MTH/1NC1-MTH_target.pdbqt | data/1N/1NC1-MTH/1NC1-MTH_decoys.pdbqt | data/1N/1NC1-MTH/1NC1-MTH_decoy_scores.csv |
1NJS-KEU | data/1N/1NJS-KEU/1NJS-KEU_ligand.pdbqt | data/1N/1NJS-KEU/1NJS-KEU_target.pdbqt | data/1N/1NJS-KEU/1NJS-KEU_decoys.pdbqt | data/1N/1NJS-KEU/1NJS-KEU_decoy_scores.csv |
1NMQ-160 | data/1N/1NMQ-160/1NMQ-160_ligand.pdbqt | data/1N/1NMQ-160/1NMQ-160_target.pdbqt | data/1N/1NMQ-160/1NMQ-160_decoys.pdbqt | data/1N/1NMQ-160/1NMQ-160_decoy_scores.csv |
1N1T-DAN | data/1N/1N1T-DAN/1N1T-DAN_ligand.pdbqt | data/1N/1N1T-DAN/1N1T-DAN_target.pdbqt | data/1N/1N1T-DAN/1N1T-DAN_decoys.pdbqt | data/1N/1N1T-DAN/1N1T-DAN_decoy_scores.csv |
1NLM-UD1 | data/1N/1NLM-UD1/1NLM-UD1_ligand.pdbqt | data/1N/1NLM-UD1/1NLM-UD1_target.pdbqt | data/1N/1NLM-UD1/1NLM-UD1_decoys.pdbqt | data/1N/1NLM-UD1/1NLM-UD1_decoy_scores.csv |
1NQM-BTN | data/1N/1NQM-BTN/1NQM-BTN_ligand.pdbqt | data/1N/1NQM-BTN/1NQM-BTN_target.pdbqt | data/1N/1NQM-BTN/1NQM-BTN_decoys.pdbqt | data/1N/1NQM-BTN/1NQM-BTN_decoy_scores.csv |
1NFW-RRR | data/1N/1NFW-RRR/1NFW-RRR_ligand.pdbqt | data/1N/1NFW-RRR/1NFW-RRR_target.pdbqt | data/1N/1NFW-RRR/1NFW-RRR_decoys.pdbqt | data/1N/1NFW-RRR/1NFW-RRR_decoy_scores.csv |
1NRG-FMN | data/1N/1NRG-FMN/1NRG-FMN_ligand.pdbqt | data/1N/1NRG-FMN/1NRG-FMN_target.pdbqt | data/1N/1NRG-FMN/1NRG-FMN_decoys.pdbqt | data/1N/1NRG-FMN/1NRG-FMN_decoy_scores.csv |
1N2I-PAJ | data/1N/1N2I-PAJ/1N2I-PAJ_ligand.pdbqt | data/1N/1N2I-PAJ/1N2I-PAJ_target.pdbqt | data/1N/1N2I-PAJ/1N2I-PAJ_decoys.pdbqt | data/1N/1N2I-PAJ/1N2I-PAJ_decoy_scores.csv |
1NZF-UPG | data/1N/1NZF-UPG/1NZF-UPG_ligand.pdbqt | data/1N/1NZF-UPG/1NZF-UPG_target.pdbqt | data/1N/1NZF-UPG/1NZF-UPG_decoys.pdbqt | data/1N/1NZF-UPG/1NZF-UPG_decoy_scores.csv |
1NFT-NTA | data/1N/1NFT-NTA/1NFT-NTA_ligand.pdbqt | data/1N/1NFT-NTA/1NFT-NTA_target.pdbqt | data/1N/1NFT-NTA/1NFT-NTA_decoys.pdbqt | data/1N/1NFT-NTA/1NFT-NTA_decoy_scores.csv |
1N62-MCN | data/1N/1N62-MCN/1N62-MCN_ligand.pdbqt | data/1N/1N62-MCN/1N62-MCN_target.pdbqt | null | null |
1NFQ-NAI | data/1N/1NFQ-NAI/1NFQ-NAI_ligand.pdbqt | data/1N/1NFQ-NAI/1NFQ-NAI_target.pdbqt | data/1N/1NFQ-NAI/1NFQ-NAI_decoys.pdbqt | data/1N/1NFQ-NAI/1NFQ-NAI_decoy_scores.csv |
1N1D-C2G | data/1N/1N1D-C2G/1N1D-C2G_ligand.pdbqt | data/1N/1N1D-C2G/1N1D-C2G_target.pdbqt | data/1N/1N1D-C2G/1N1D-C2G_decoys.pdbqt | data/1N/1N1D-C2G/1N1D-C2G_decoy_scores.csv |
1NMY-FDM | data/1N/1NMY-FDM/1NMY-FDM_ligand.pdbqt | data/1N/1NMY-FDM/1NMY-FDM_target.pdbqt | data/1N/1NMY-FDM/1NMY-FDM_decoys.pdbqt | data/1N/1NMY-FDM/1NMY-FDM_decoy_scores.csv |
1NV7-F6P | data/1N/1NV7-F6P/1NV7-F6P_ligand.pdbqt | data/1N/1NV7-F6P/1NV7-F6P_target.pdbqt | null | null |
1NRR-0G6 | data/1N/1NRR-0G6/1NRR-0G6_ligand.pdbqt | data/1N/1NRR-0G6/1NRR-0G6_target.pdbqt | data/1N/1NRR-0G6/1NRR-0G6_decoys.pdbqt | data/1N/1NRR-0G6/1NRR-0G6_decoy_scores.csv |
1NCQ-W11 | data/1N/1NCQ-W11/1NCQ-W11_ligand.pdbqt | data/1N/1NCQ-W11/1NCQ-W11_target.pdbqt | data/1N/1NCQ-W11/1NCQ-W11_decoys.pdbqt | data/1N/1NCQ-W11/1NCQ-W11_decoy_scores.csv |
1N22-7A8 | data/1N/1N22-7A8/1N22-7A8_ligand.pdbqt | data/1N/1N22-7A8/1N22-7A8_target.pdbqt | data/1N/1N22-7A8/1N22-7A8_decoys.pdbqt | data/1N/1N22-7A8/1N22-7A8_decoy_scores.csv |
1NFU-RRP | data/1N/1NFU-RRP/1NFU-RRP_ligand.pdbqt | data/1N/1NFU-RRP/1NFU-RRP_target.pdbqt | data/1N/1NFU-RRP/1NFU-RRP_decoys.pdbqt | data/1N/1NFU-RRP/1NFU-RRP_decoy_scores.csv |
1N7H-GDP | data/1N/1N7H-GDP/1N7H-GDP_ligand.pdbqt | data/1N/1N7H-GDP/1N7H-GDP_target.pdbqt | data/1N/1N7H-GDP/1N7H-GDP_decoys.pdbqt | data/1N/1N7H-GDP/1N7H-GDP_decoy_scores.csv |
1NAI-NAD | data/1N/1NAI-NAD/1NAI-NAD_ligand.pdbqt | data/1N/1NAI-NAD/1NAI-NAD_target.pdbqt | data/1N/1NAI-NAD/1NAI-NAD_decoys.pdbqt | data/1N/1NAI-NAD/1NAI-NAD_decoy_scores.csv |
1NHT-GDP | data/1N/1NHT-GDP/1NHT-GDP_ligand.pdbqt | data/1N/1NHT-GDP/1NHT-GDP_target.pdbqt | data/1N/1NHT-GDP/1NHT-GDP_decoys.pdbqt | data/1N/1NHT-GDP/1NHT-GDP_decoy_scores.csv |
1N1Z-BTB | data/1N/1N1Z-BTB/1N1Z-BTB_ligand.pdbqt | data/1N/1N1Z-BTB/1N1Z-BTB_target.pdbqt | data/1N/1N1Z-BTB/1N1Z-BTB_decoys.pdbqt | data/1N/1N1Z-BTB/1N1Z-BTB_decoy_scores.csv |
1NQO-G3H | data/1N/1NQO-G3H/1NQO-G3H_ligand.pdbqt | data/1N/1NQO-G3H/1NQO-G3H_target.pdbqt | data/1N/1NQO-G3H/1NQO-G3H_decoys.pdbqt | data/1N/1NQO-G3H/1NQO-G3H_decoy_scores.csv |
1NI1-2C5 | data/1N/1NI1-2C5/1NI1-2C5_ligand.pdbqt | data/1N/1NI1-2C5/1NI1-2C5_target.pdbqt | data/1N/1NI1-2C5/1NI1-2C5_decoys.pdbqt | data/1N/1NI1-2C5/1NI1-2C5_decoy_scores.csv |
1N6P-GNP | data/1N/1N6P-GNP/1N6P-GNP_ligand.pdbqt | data/1N/1N6P-GNP/1N6P-GNP_target.pdbqt | data/1N/1N6P-GNP/1N6P-GNP_decoys.pdbqt | data/1N/1N6P-GNP/1N6P-GNP_decoy_scores.csv |
1NZZ-NAI | data/1N/1NZZ-NAI/1NZZ-NAI_ligand.pdbqt | data/1N/1NZZ-NAI/1NZZ-NAI_target.pdbqt | data/1N/1NZZ-NAI/1NZZ-NAI_decoys.pdbqt | data/1N/1NZZ-NAI/1NZZ-NAI_decoy_scores.csv |
1NS2-GAL | data/1N/1NS2-GAL/1NS2-GAL_ligand.pdbqt | data/1N/1NS2-GAL/1NS2-GAL_target.pdbqt | data/1N/1NS2-GAL/1NS2-GAL_decoys.pdbqt | data/1N/1NS2-GAL/1NS2-GAL_decoy_scores.csv |
1NVS-UCM | data/1N/1NVS-UCM/1NVS-UCM_ligand.pdbqt | data/1N/1NVS-UCM/1NVS-UCM_target.pdbqt | data/1N/1NVS-UCM/1NVS-UCM_decoys.pdbqt | data/1N/1NVS-UCM/1NVS-UCM_decoy_scores.csv |
1NE8-1PG | data/1N/1NE8-1PG/1NE8-1PG_ligand.pdbqt | data/1N/1NE8-1PG/1NE8-1PG_target.pdbqt | data/1N/1NE8-1PG/1NE8-1PG_decoys.pdbqt | data/1N/1NE8-1PG/1NE8-1PG_decoy_scores.csv |
1NWG-BGN | data/1N/1NWG-BGN/1NWG-BGN_ligand.pdbqt | data/1N/1NWG-BGN/1NWG-BGN_target.pdbqt | data/1N/1NWG-BGN/1NWG-BGN_decoys.pdbqt | data/1N/1NWG-BGN/1NWG-BGN_decoy_scores.csv |
1NM6-L86 | data/1N/1NM6-L86/1NM6-L86_ligand.pdbqt | data/1N/1NM6-L86/1NM6-L86_target.pdbqt | data/1N/1NM6-L86/1NM6-L86_decoys.pdbqt | data/1N/1NM6-L86/1NM6-L86_decoy_scores.csv |
1NUP-NMN | data/1N/1NUP-NMN/1NUP-NMN_ligand.pdbqt | data/1N/1NUP-NMN/1NUP-NMN_target.pdbqt | data/1N/1NUP-NMN/1NUP-NMN_decoys.pdbqt | data/1N/1NUP-NMN/1NUP-NMN_decoy_scores.csv |
1NM5-NAD | data/1N/1NM5-NAD/1NM5-NAD_ligand.pdbqt | data/1N/1NM5-NAD/1NM5-NAD_target.pdbqt | data/1N/1NM5-NAD/1NM5-NAD_decoys.pdbqt | data/1N/1NM5-NAD/1NM5-NAD_decoy_scores.csv |
1NO6-794 | data/1N/1NO6-794/1NO6-794_ligand.pdbqt | data/1N/1NO6-794/1NO6-794_target.pdbqt | data/1N/1NO6-794/1NO6-794_decoys.pdbqt | data/1N/1NO6-794/1NO6-794_decoy_scores.csv |
1NIS-NTC | data/1N/1NIS-NTC/1NIS-NTC_ligand.pdbqt | data/1N/1NIS-NTC/1NIS-NTC_target.pdbqt | data/1N/1NIS-NTC/1NIS-NTC_decoys.pdbqt | data/1N/1NIS-NTC/1NIS-NTC_decoy_scores.csv |
1N8Q-DHB | data/1N/1N8Q-DHB/1N8Q-DHB_ligand.pdbqt | data/1N/1N8Q-DHB/1N8Q-DHB_target.pdbqt | data/1N/1N8Q-DHB/1N8Q-DHB_decoys.pdbqt | data/1N/1N8Q-DHB/1N8Q-DHB_decoy_scores.csv |
1NJE-DCM | data/1N/1NJE-DCM/1NJE-DCM_ligand.pdbqt | data/1N/1NJE-DCM/1NJE-DCM_target.pdbqt | data/1N/1NJE-DCM/1NJE-DCM_decoys.pdbqt | data/1N/1NJE-DCM/1NJE-DCM_decoy_scores.csv |
1NC4-DOF | data/1N/1NC4-DOF/1NC4-DOF_ligand.pdbqt | data/1N/1NC4-DOF/1NC4-DOF_target.pdbqt | null | null |
1N7G-GDR | data/1N/1N7G-GDR/1N7G-GDR_ligand.pdbqt | data/1N/1N7G-GDR/1N7G-GDR_target.pdbqt | data/1N/1N7G-GDR/1N7G-GDR_decoys.pdbqt | data/1N/1N7G-GDR/1N7G-GDR_decoy_scores.csv |
1N63-MCN | data/1N/1N63-MCN/1N63-MCN_ligand.pdbqt | data/1N/1N63-MCN/1N63-MCN_target.pdbqt | null | null |
1ND4-KAN | data/1N/1ND4-KAN/1ND4-KAN_ligand.pdbqt | data/1N/1ND4-KAN/1ND4-KAN_target.pdbqt | data/1N/1ND4-KAN/1ND4-KAN_decoys.pdbqt | data/1N/1ND4-KAN/1ND4-KAN_decoy_scores.csv |
1NV1-F6P | data/1N/1NV1-F6P/1NV1-F6P_ligand.pdbqt | data/1N/1NV1-F6P/1NV1-F6P_target.pdbqt | null | null |
Subsets and Splits
No community queries yet
The top public SQL queries from the community will appear here once available.