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 ⌀ |
|---|---|---|---|---|
3N8K-D1X | data/3N/3N8K-D1X/3N8K-D1X_ligand.pdbqt | data/3N/3N8K-D1X/3N8K-D1X_target.pdbqt | data/3N/3N8K-D1X/3N8K-D1X_decoys.pdbqt | data/3N/3N8K-D1X/3N8K-D1X_decoy_scores.csv |
3NG7-HNL | data/3N/3NG7-HNL/3NG7-HNL_ligand.pdbqt | data/3N/3NG7-HNL/3NG7-HNL_target.pdbqt | data/3N/3NG7-HNL/3NG7-HNL_decoys.pdbqt | data/3N/3NG7-HNL/3NG7-HNL_decoy_scores.csv |
3NZ0-IZA | data/3N/3NZ0-IZA/3NZ0-IZA_ligand.pdbqt | data/3N/3NZ0-IZA/3NZ0-IZA_target.pdbqt | data/3N/3NZ0-IZA/3NZ0-IZA_decoys.pdbqt | data/3N/3NZ0-IZA/3NZ0-IZA_decoy_scores.csv |
3NUN-JMZ | data/3N/3NUN-JMZ/3NUN-JMZ_ligand.pdbqt | data/3N/3NUN-JMZ/3NUN-JMZ_target.pdbqt | data/3N/3NUN-JMZ/3NUN-JMZ_decoys.pdbqt | data/3N/3NUN-JMZ/3NUN-JMZ_decoy_scores.csv |
3NAX-MP7 | data/3N/3NAX-MP7/3NAX-MP7_ligand.pdbqt | data/3N/3NAX-MP7/3NAX-MP7_target.pdbqt | data/3N/3NAX-MP7/3NAX-MP7_decoys.pdbqt | data/3N/3NAX-MP7/3NAX-MP7_decoy_scores.csv |
3N8R-CB9 | data/3N/3N8R-CB9/3N8R-CB9_ligand.pdbqt | data/3N/3N8R-CB9/3N8R-CB9_target.pdbqt | data/3N/3N8R-CB9/3N8R-CB9_decoys.pdbqt | data/3N/3N8R-CB9/3N8R-CB9_decoy_scores.csv |
3NA0-2DC | data/3N/3NA0-2DC/3NA0-2DC_ligand.pdbqt | data/3N/3NA0-2DC/3NA0-2DC_target.pdbqt | data/3N/3NA0-2DC/3NA0-2DC_decoys.pdbqt | data/3N/3NA0-2DC/3NA0-2DC_decoy_scores.csv |
3N1S-5GP | data/3N/3N1S-5GP/3N1S-5GP_ligand.pdbqt | data/3N/3N1S-5GP/3N1S-5GP_target.pdbqt | data/3N/3N1S-5GP/3N1S-5GP_decoys.pdbqt | data/3N/3N1S-5GP/3N1S-5GP_decoy_scores.csv |
3NG5-KDH | data/3N/3NG5-KDH/3NG5-KDH_ligand.pdbqt | data/3N/3NG5-KDH/3NG5-KDH_target.pdbqt | data/3N/3NG5-KDH/3NG5-KDH_decoys.pdbqt | data/3N/3NG5-KDH/3NG5-KDH_decoy_scores.csv |
3NZ1-3NY | data/3N/3NZ1-3NY/3NZ1-3NY_ligand.pdbqt | data/3N/3NZ1-3NY/3NZ1-3NY_target.pdbqt | data/3N/3NZ1-3NY/3NZ1-3NY_decoys.pdbqt | data/3N/3NZ1-3NY/3NZ1-3NY_decoy_scores.csv |
3NLF-JRS | data/3N/3NLF-JRS/3NLF-JRS_ligand.pdbqt | data/3N/3NLF-JRS/3NLF-JRS_target.pdbqt | null | null |
3NXS-GDP | data/3N/3NXS-GDP/3NXS-GDP_ligand.pdbqt | data/3N/3NXS-GDP/3NXS-GDP_target.pdbqt | data/3N/3NXS-GDP/3NXS-GDP_decoys.pdbqt | data/3N/3NXS-GDP/3NXS-GDP_decoy_scores.csv |
3NVV-MTE | data/3N/3NVV-MTE/3NVV-MTE_ligand.pdbqt | data/3N/3NVV-MTE/3NVV-MTE_target.pdbqt | null | null |
3NJ0-PYV | data/3N/3NJ0-PYV/3NJ0-PYV_ligand.pdbqt | data/3N/3NJ0-PYV/3NJ0-PYV_target.pdbqt | data/3N/3NJ0-PYV/3NJ0-PYV_decoys.pdbqt | data/3N/3NJ0-PYV/3NJ0-PYV_decoy_scores.csv |
3NQS-AT2 | data/3N/3NQS-AT2/3NQS-AT2_ligand.pdbqt | data/3N/3NQS-AT2/3NQS-AT2_target.pdbqt | data/3N/3NQS-AT2/3NQS-AT2_decoys.pdbqt | data/3N/3NQS-AT2/3NQS-AT2_decoy_scores.csv |
3ND1-SAH | data/3N/3ND1-SAH/3ND1-SAH_ligand.pdbqt | data/3N/3ND1-SAH/3ND1-SAH_target.pdbqt | data/3N/3ND1-SAH/3ND1-SAH_decoys.pdbqt | data/3N/3ND1-SAH/3ND1-SAH_decoy_scores.csv |
3NLF-H4B | data/3N/3NLF-H4B/3NLF-H4B_ligand.pdbqt | data/3N/3NLF-H4B/3NLF-H4B_target.pdbqt | null | null |
3N2V-JT5 | data/3N/3N2V-JT5/3N2V-JT5_ligand.pdbqt | data/3N/3N2V-JT5/3N2V-JT5_target.pdbqt | data/3N/3N2V-JT5/3N2V-JT5_decoys.pdbqt | data/3N/3N2V-JT5/3N2V-JT5_decoy_scores.csv |
3NC2-QUZ | data/3N/3NC2-QUZ/3NC2-QUZ_ligand.pdbqt | data/3N/3NC2-QUZ/3NC2-QUZ_target.pdbqt | data/3N/3NC2-QUZ/3NC2-QUZ_decoys.pdbqt | data/3N/3NC2-QUZ/3NC2-QUZ_decoy_scores.csv |
3NLR-JRS | data/3N/3NLR-JRS/3NLR-JRS_ligand.pdbqt | data/3N/3NLR-JRS/3NLR-JRS_target.pdbqt | data/3N/3NLR-JRS/3NLR-JRS_decoys.pdbqt | data/3N/3NLR-JRS/3NLR-JRS_decoy_scores.csv |
3NLD-H4B | data/3N/3NLD-H4B/3NLD-H4B_ligand.pdbqt | data/3N/3NLD-H4B/3NLD-H4B_target.pdbqt | null | null |
3NRZ-MTE | data/3N/3NRZ-MTE/3NRZ-MTE_ligand.pdbqt | data/3N/3NRZ-MTE/3NRZ-MTE_target.pdbqt | null | null |
3NZD-D2Q | data/3N/3NZD-D2Q/3NZD-D2Q_ligand.pdbqt | data/3N/3NZD-D2Q/3NZD-D2Q_target.pdbqt | data/3N/3NZD-D2Q/3NZD-D2Q_decoys.pdbqt | data/3N/3NZD-D2Q/3NZD-D2Q_decoy_scores.csv |
3NEX-G24 | data/3N/3NEX-G24/3NEX-G24_ligand.pdbqt | data/3N/3NEX-G24/3NEX-G24_target.pdbqt | data/3N/3NEX-G24/3NEX-G24_decoys.pdbqt | data/3N/3NEX-G24/3NEX-G24_decoy_scores.csv |
3NU5-478 | data/3N/3NU5-478/3NU5-478_ligand.pdbqt | data/3N/3NU5-478/3NU5-478_target.pdbqt | data/3N/3NU5-478/3NU5-478_decoys.pdbqt | data/3N/3NU5-478/3NU5-478_decoy_scores.csv |
3NMQ-7PP | data/3N/3NMQ-7PP/3NMQ-7PP_ligand.pdbqt | data/3N/3NMQ-7PP/3NMQ-7PP_target.pdbqt | data/3N/3NMQ-7PP/3NMQ-7PP_decoys.pdbqt | data/3N/3NMQ-7PP/3NMQ-7PP_decoy_scores.csv |
3NG7-HNK | data/3N/3NG7-HNK/3NG7-HNK_ligand.pdbqt | data/3N/3NG7-HNK/3NG7-HNK_target.pdbqt | data/3N/3NG7-HNK/3NG7-HNK_decoys.pdbqt | data/3N/3NG7-HNK/3NG7-HNK_decoy_scores.csv |
3NM6-ADE | data/3N/3NM6-ADE/3NM6-ADE_ligand.pdbqt | data/3N/3NM6-ADE/3NM6-ADE_target.pdbqt | data/3N/3NM6-ADE/3NM6-ADE_decoys.pdbqt | data/3N/3NM6-ADE/3NM6-ADE_decoy_scores.csv |
3NDU-ROC | data/3N/3NDU-ROC/3NDU-ROC_ligand.pdbqt | data/3N/3NDU-ROC/3NDU-ROC_target.pdbqt | data/3N/3NDU-ROC/3NDU-ROC_decoys.pdbqt | data/3N/3NDU-ROC/3NDU-ROC_decoy_scores.csv |
3NK7-SAM | data/3N/3NK7-SAM/3NK7-SAM_ligand.pdbqt | data/3N/3NK7-SAM/3NK7-SAM_target.pdbqt | data/3N/3NK7-SAM/3NK7-SAM_decoys.pdbqt | data/3N/3NK7-SAM/3NK7-SAM_decoy_scores.csv |
3NOQ-NHE | data/3N/3NOQ-NHE/3NOQ-NHE_ligand.pdbqt | data/3N/3NOQ-NHE/3NOQ-NHE_target.pdbqt | data/3N/3NOQ-NHE/3NOQ-NHE_decoys.pdbqt | data/3N/3NOQ-NHE/3NOQ-NHE_decoy_scores.csv |
3NNY-H4B | data/3N/3NNY-H4B/3NNY-H4B_ligand.pdbqt | data/3N/3NNY-H4B/3NNY-H4B_target.pdbqt | data/3N/3NNY-H4B/3NNY-H4B_decoys.pdbqt | data/3N/3NNY-H4B/3NNY-H4B_decoy_scores.csv |
3N7S-3N7 | data/3N/3N7S-3N7/3N7S-3N7_ligand.pdbqt | data/3N/3N7S-3N7/3N7S-3N7_target.pdbqt | data/3N/3N7S-3N7/3N7S-3N7_decoys.pdbqt | data/3N/3N7S-3N7/3N7S-3N7_decoy_scores.csv |
3NHL-YTR | data/3N/3NHL-YTR/3NHL-YTR_ligand.pdbqt | data/3N/3NHL-YTR/3NHL-YTR_target.pdbqt | data/3N/3NHL-YTR/3NHL-YTR_decoys.pdbqt | data/3N/3NHL-YTR/3NHL-YTR_decoy_scores.csv |
3N26-ARG | data/3N/3N26-ARG/3N26-ARG_ligand.pdbqt | data/3N/3N26-ARG/3N26-ARG_target.pdbqt | data/3N/3N26-ARG/3N26-ARG_decoys.pdbqt | data/3N/3N26-ARG/3N26-ARG_decoy_scores.csv |
3NEV-RSH | data/3N/3NEV-RSH/3NEV-RSH_ligand.pdbqt | data/3N/3NEV-RSH/3NEV-RSH_target.pdbqt | data/3N/3NEV-RSH/3NEV-RSH_decoys.pdbqt | data/3N/3NEV-RSH/3NEV-RSH_decoy_scores.csv |
3NPD-CXS | data/3N/3NPD-CXS/3NPD-CXS_ligand.pdbqt | data/3N/3NPD-CXS/3NPD-CXS_target.pdbqt | data/3N/3NPD-CXS/3NPD-CXS_decoys.pdbqt | data/3N/3NPD-CXS/3NPD-CXS_decoy_scores.csv |
3NTL-IHP | data/3N/3NTL-IHP/3NTL-IHP_ligand.pdbqt | data/3N/3NTL-IHP/3NTL-IHP_target.pdbqt | data/3N/3NTL-IHP/3NTL-IHP_decoys.pdbqt | data/3N/3NTL-IHP/3NTL-IHP_decoy_scores.csv |
3NNZ-59W | data/3N/3NNZ-59W/3NNZ-59W_ligand.pdbqt | data/3N/3NNZ-59W/3NNZ-59W_target.pdbqt | data/3N/3NNZ-59W/3NNZ-59W_decoys.pdbqt | data/3N/3NNZ-59W/3NNZ-59W_decoy_scores.csv |
3NIA-TF7 | data/3N/3NIA-TF7/3NIA-TF7_ligand.pdbqt | data/3N/3NIA-TF7/3NIA-TF7_target.pdbqt | data/3N/3NIA-TF7/3NIA-TF7_decoys.pdbqt | data/3N/3NIA-TF7/3NIA-TF7_decoy_scores.csv |
3NTP-RZD | data/3N/3NTP-RZD/3NTP-RZD_ligand.pdbqt | data/3N/3NTP-RZD/3NTP-RZD_target.pdbqt | data/3N/3NTP-RZD/3NTP-RZD_decoys.pdbqt | data/3N/3NTP-RZD/3NTP-RZD_decoy_scores.csv |
3NU0-3TU | data/3N/3NU0-3TU/3NU0-3TU_ligand.pdbqt | data/3N/3NU0-3TU/3NU0-3TU_target.pdbqt | data/3N/3NU0-3TU/3NU0-3TU_decoys.pdbqt | data/3N/3NU0-3TU/3NU0-3TU_decoy_scores.csv |
3N33-AES | data/3N/3N33-AES/3N33-AES_ligand.pdbqt | data/3N/3N33-AES/3N33-AES_target.pdbqt | data/3N/3N33-AES/3N33-AES_decoys.pdbqt | data/3N/3N33-AES/3N33-AES_decoy_scores.csv |
3NLO-H4B | data/3N/3NLO-H4B/3NLO-H4B_ligand.pdbqt | data/3N/3NLO-H4B/3NLO-H4B_target.pdbqt | data/3N/3NLO-H4B/3NLO-H4B_decoys.pdbqt | data/3N/3NLO-H4B/3NLO-H4B_decoy_scores.csv |
3NN6-HNK | data/3N/3NN6-HNK/3NN6-HNK_ligand.pdbqt | data/3N/3NN6-HNK/3NN6-HNK_target.pdbqt | data/3N/3NN6-HNK/3NN6-HNK_decoys.pdbqt | data/3N/3NN6-HNK/3NN6-HNK_decoy_scores.csv |
3NQV-BEN | data/3N/3NQV-BEN/3NQV-BEN_ligand.pdbqt | data/3N/3NQV-BEN/3NQV-BEN_target.pdbqt | data/3N/3NQV-BEN/3NQV-BEN_decoys.pdbqt | data/3N/3NQV-BEN/3NQV-BEN_decoy_scores.csv |
3N5C-GDP | data/3N/3N5C-GDP/3N5C-GDP_ligand.pdbqt | data/3N/3N5C-GDP/3N5C-GDP_target.pdbqt | data/3N/3N5C-GDP/3N5C-GDP_decoys.pdbqt | data/3N/3N5C-GDP/3N5C-GDP_decoy_scores.csv |
3NZ9-D2K | data/3N/3NZ9-D2K/3NZ9-D2K_ligand.pdbqt | data/3N/3NZ9-D2K/3NZ9-D2K_target.pdbqt | data/3N/3NZ9-D2K/3NZ9-D2K_decoys.pdbqt | data/3N/3NZ9-D2K/3NZ9-D2K_decoy_scores.csv |
3NWB-NHE | data/3N/3NWB-NHE/3NWB-NHE_ligand.pdbqt | data/3N/3NWB-NHE/3NWB-NHE_target.pdbqt | data/3N/3NWB-NHE/3NWB-NHE_decoys.pdbqt | data/3N/3NWB-NHE/3NWB-NHE_decoy_scores.csv |
3NLM-H4B | data/3N/3NLM-H4B/3NLM-H4B_ligand.pdbqt | data/3N/3NLM-H4B/3NLM-H4B_target.pdbqt | data/3N/3NLM-H4B/3NLM-H4B_decoys.pdbqt | data/3N/3NLM-H4B/3NLM-H4B_decoy_scores.csv |
3N2R-XJH | data/3N/3N2R-XJH/3N2R-XJH_ligand.pdbqt | data/3N/3N2R-XJH/3N2R-XJH_target.pdbqt | data/3N/3N2R-XJH/3N2R-XJH_decoys.pdbqt | data/3N/3N2R-XJH/3N2R-XJH_decoy_scores.csv |
3NBL-DXF | data/3N/3NBL-DXF/3NBL-DXF_ligand.pdbqt | data/3N/3NBL-DXF/3NBL-DXF_target.pdbqt | data/3N/3NBL-DXF/3NBL-DXF_decoys.pdbqt | data/3N/3NBL-DXF/3NBL-DXF_decoy_scores.csv |
3NLQ-H4B | data/3N/3NLQ-H4B/3NLQ-H4B_ligand.pdbqt | data/3N/3NLQ-H4B/3NLQ-H4B_target.pdbqt | data/3N/3NLQ-H4B/3NLQ-H4B_decoys.pdbqt | data/3N/3NLQ-H4B/3NLQ-H4B_decoy_scores.csv |
3NVW-MTE | data/3N/3NVW-MTE/3NVW-MTE_ligand.pdbqt | data/3N/3NVW-MTE/3NVW-MTE_target.pdbqt | null | null |
3NXW-THP | data/3N/3NXW-THP/3NXW-THP_ligand.pdbqt | data/3N/3NXW-THP/3NXW-THP_target.pdbqt | data/3N/3NXW-THP/3NXW-THP_decoys.pdbqt | data/3N/3NXW-THP/3NXW-THP_decoy_scores.csv |
3NHP-HGZ | data/3N/3NHP-HGZ/3NHP-HGZ_ligand.pdbqt | data/3N/3NHP-HGZ/3NHP-HGZ_target.pdbqt | data/3N/3NHP-HGZ/3NHP-HGZ_decoys.pdbqt | data/3N/3NHP-HGZ/3NHP-HGZ_decoy_scores.csv |
3N8H-AMP | data/3N/3N8H-AMP/3N8H-AMP_ligand.pdbqt | data/3N/3N8H-AMP/3N8H-AMP_target.pdbqt | data/3N/3N8H-AMP/3N8H-AMP_decoys.pdbqt | data/3N/3N8H-AMP/3N8H-AMP_decoy_scores.csv |
3NFB-OAE | data/3N/3NFB-OAE/3NFB-OAE_ligand.pdbqt | data/3N/3NFB-OAE/3NFB-OAE_target.pdbqt | data/3N/3NFB-OAE/3NFB-OAE_decoys.pdbqt | data/3N/3NFB-OAE/3NFB-OAE_decoy_scores.csv |
3NYE-IAR | data/3N/3NYE-IAR/3NYE-IAR_ligand.pdbqt | data/3N/3NYE-IAR/3NYE-IAR_target.pdbqt | data/3N/3NYE-IAR/3NYE-IAR_decoys.pdbqt | data/3N/3NYE-IAR/3NYE-IAR_decoy_scores.csv |
3N76-CA2 | data/3N/3N76-CA2/3N76-CA2_ligand.pdbqt | data/3N/3N76-CA2/3N76-CA2_target.pdbqt | data/3N/3N76-CA2/3N76-CA2_decoys.pdbqt | data/3N/3N76-CA2/3N76-CA2_decoy_scores.csv |
3NT2-NAI | data/3N/3NT2-NAI/3NT2-NAI_ligand.pdbqt | data/3N/3NT2-NAI/3NT2-NAI_target.pdbqt | data/3N/3NT2-NAI/3NT2-NAI_decoys.pdbqt | data/3N/3NT2-NAI/3NT2-NAI_decoy_scores.csv |
3NGU-ADP | data/3N/3NGU-ADP/3NGU-ADP_ligand.pdbqt | data/3N/3NGU-ADP/3NGU-ADP_target.pdbqt | data/3N/3NGU-ADP/3NGU-ADP_decoys.pdbqt | data/3N/3NGU-ADP/3NGU-ADP_decoy_scores.csv |
3NLB-5BE | data/3N/3NLB-5BE/3NLB-5BE_ligand.pdbqt | data/3N/3NLB-5BE/3NLB-5BE_target.pdbqt | data/3N/3NLB-5BE/3NLB-5BE_decoys.pdbqt | data/3N/3NLB-5BE/3NLB-5BE_decoy_scores.csv |
3N75-P6G | data/3N/3N75-P6G/3N75-P6G_ligand.pdbqt | data/3N/3N75-P6G/3N75-P6G_target.pdbqt | data/3N/3N75-P6G/3N75-P6G_decoys.pdbqt | data/3N/3N75-P6G/3N75-P6G_decoy_scores.csv |
3NYV-DTQ | data/3N/3NYV-DTQ/3NYV-DTQ_ligand.pdbqt | data/3N/3NYV-DTQ/3NYV-DTQ_target.pdbqt | data/3N/3NYV-DTQ/3NYV-DTQ_decoys.pdbqt | data/3N/3NYV-DTQ/3NYV-DTQ_decoy_scores.csv |
3NWN-ADP | data/3N/3NWN-ADP/3NWN-ADP_ligand.pdbqt | data/3N/3NWN-ADP/3NWN-ADP_target.pdbqt | data/3N/3NWN-ADP/3NWN-ADP_decoys.pdbqt | data/3N/3NWN-ADP/3NWN-ADP_decoy_scores.csv |
3NLI-JRR | data/3N/3NLI-JRR/3NLI-JRR_ligand.pdbqt | data/3N/3NLI-JRR/3NLI-JRR_target.pdbqt | null | null |
3NK1-SRO | data/3N/3NK1-SRO/3NK1-SRO_ligand.pdbqt | data/3N/3NK1-SRO/3NK1-SRO_target.pdbqt | data/3N/3NK1-SRO/3NK1-SRO_decoys.pdbqt | data/3N/3NK1-SRO/3NK1-SRO_decoy_scores.csv |
3NP7-Z15 | data/3N/3NP7-Z15/3NP7-Z15_ligand.pdbqt | data/3N/3NP7-Z15/3NP7-Z15_target.pdbqt | data/3N/3NP7-Z15/3NP7-Z15_decoys.pdbqt | data/3N/3NP7-Z15/3NP7-Z15_decoy_scores.csv |
3N6A-XFK | data/3N/3N6A-XFK/3N6A-XFK_ligand.pdbqt | data/3N/3N6A-XFK/3N6A-XFK_target.pdbqt | null | null |
3NYD-3NY | data/3N/3NYD-3NY/3NYD-3NY_ligand.pdbqt | data/3N/3NYD-3NY/3NYD-3NY_target.pdbqt | data/3N/3NYD-3NY/3NYD-3NY_decoys.pdbqt | data/3N/3NYD-3NY/3NYD-3NY_decoy_scores.csv |
3NJO-P2M | data/3N/3NJO-P2M/3NJO-P2M_ligand.pdbqt | data/3N/3NJO-P2M/3NJO-P2M_target.pdbqt | data/3N/3NJO-P2M/3NJO-P2M_decoys.pdbqt | data/3N/3NJO-P2M/3NJO-P2M_decoy_scores.csv |
3NNV-437 | data/3N/3NNV-437/3NNV-437_ligand.pdbqt | data/3N/3NNV-437/3NNV-437_target.pdbqt | data/3N/3NNV-437/3NNV-437_decoys.pdbqt | data/3N/3NNV-437/3NNV-437_decoy_scores.csv |
3N64-XFN | data/3N/3N64-XFN/3N64-XFN_ligand.pdbqt | data/3N/3N64-XFN/3N64-XFN_target.pdbqt | data/3N/3N64-XFN/3N64-XFN_decoys.pdbqt | data/3N/3N64-XFN/3N64-XFN_decoy_scores.csv |
3NWP-P6G | data/3N/3NWP-P6G/3NWP-P6G_ligand.pdbqt | data/3N/3NWP-P6G/3NWP-P6G_target.pdbqt | data/3N/3NWP-P6G/3NWP-P6G_decoys.pdbqt | data/3N/3NWP-P6G/3NWP-P6G_decoy_scores.csv |
3NNW-EDD | data/3N/3NNW-EDD/3NNW-EDD_ligand.pdbqt | data/3N/3NNW-EDD/3NNW-EDD_target.pdbqt | data/3N/3NNW-EDD/3NNW-EDD_decoys.pdbqt | data/3N/3NNW-EDD/3NNW-EDD_decoy_scores.csv |
3NLG-JSR | data/3N/3NLG-JSR/3NLG-JSR_ligand.pdbqt | data/3N/3NLG-JSR/3NLG-JSR_target.pdbqt | null | null |
3NEO-G24 | data/3N/3NEO-G24/3NEO-G24_ligand.pdbqt | data/3N/3NEO-G24/3NEO-G24_target.pdbqt | data/3N/3NEO-G24/3NEO-G24_decoys.pdbqt | data/3N/3NEO-G24/3NEO-G24_decoy_scores.csv |
3NS2-PYV | data/3N/3NS2-PYV/3NS2-PYV_ligand.pdbqt | data/3N/3NS2-PYV/3NS2-PYV_target.pdbqt | data/3N/3NS2-PYV/3NS2-PYV_decoys.pdbqt | data/3N/3NS2-PYV/3NS2-PYV_decoy_scores.csv |
3N5J-GO1 | data/3N/3N5J-GO1/3N5J-GO1_ligand.pdbqt | data/3N/3N5J-GO1/3N5J-GO1_target.pdbqt | data/3N/3N5J-GO1/3N5J-GO1_decoys.pdbqt | data/3N/3N5J-GO1/3N5J-GO1_decoy_scores.csv |
3N9Z-HC9 | data/3N/3N9Z-HC9/3N9Z-HC9_ligand.pdbqt | data/3N/3N9Z-HC9/3N9Z-HC9_target.pdbqt | data/3N/3N9Z-HC9/3N9Z-HC9_decoys.pdbqt | data/3N/3N9Z-HC9/3N9Z-HC9_decoy_scores.csv |
3NHS-MZX | data/3N/3NHS-MZX/3NHS-MZX_ligand.pdbqt | data/3N/3NHS-MZX/3NHS-MZX_target.pdbqt | data/3N/3NHS-MZX/3NHS-MZX_decoys.pdbqt | data/3N/3NHS-MZX/3NHS-MZX_decoy_scores.csv |
3N66-MTL | data/3N/3N66-MTL/3N66-MTL_ligand.pdbqt | data/3N/3N66-MTL/3N66-MTL_target.pdbqt | data/3N/3N66-MTL/3N66-MTL_decoys.pdbqt | data/3N/3N66-MTL/3N66-MTL_decoy_scores.csv |
3NJZ-SAL | data/3N/3NJZ-SAL/3NJZ-SAL_ligand.pdbqt | data/3N/3NJZ-SAL/3NJZ-SAL_target.pdbqt | data/3N/3NJZ-SAL/3NJZ-SAL_decoys.pdbqt | data/3N/3NJZ-SAL/3NJZ-SAL_decoy_scores.csv |
3NBR-ASD | data/3N/3NBR-ASD/3NBR-ASD_ligand.pdbqt | data/3N/3NBR-ASD/3NBR-ASD_target.pdbqt | data/3N/3NBR-ASD/3NBR-ASD_decoys.pdbqt | data/3N/3NBR-ASD/3NBR-ASD_decoy_scores.csv |
3NRR-UMP | data/3N/3NRR-UMP/3NRR-UMP_ligand.pdbqt | data/3N/3NRR-UMP/3NRR-UMP_target.pdbqt | data/3N/3NRR-UMP/3NRR-UMP_decoys.pdbqt | data/3N/3NRR-UMP/3NRR-UMP_decoy_scores.csv |
3NXT-D2E | data/3N/3NXT-D2E/3NXT-D2E_ligand.pdbqt | data/3N/3NXT-D2E/3NXT-D2E_target.pdbqt | data/3N/3NXT-D2E/3NXT-D2E_decoys.pdbqt | data/3N/3NXT-D2E/3NXT-D2E_decoy_scores.csv |
3N5H-GO0 | data/3N/3N5H-GO0/3N5H-GO0_ligand.pdbqt | data/3N/3N5H-GO0/3N5H-GO0_target.pdbqt | data/3N/3N5H-GO0/3N5H-GO0_decoys.pdbqt | data/3N/3N5H-GO0/3N5H-GO0_decoy_scores.csv |
3NN6-GP7 | data/3N/3NN6-GP7/3NN6-GP7_ligand.pdbqt | data/3N/3NN6-GP7/3NN6-GP7_target.pdbqt | data/3N/3NN6-GP7/3NN6-GP7_decoys.pdbqt | data/3N/3NN6-GP7/3NN6-GP7_decoy_scores.csv |
3NLK-JSS | data/3N/3NLK-JSS/3NLK-JSS_ligand.pdbqt | data/3N/3NLK-JSS/3NLK-JSS_target.pdbqt | data/3N/3NLK-JSS/3NLK-JSS_decoys.pdbqt | data/3N/3NLK-JSS/3NLK-JSS_decoy_scores.csv |
3N9R-TD3 | data/3N/3N9R-TD3/3N9R-TD3_ligand.pdbqt | data/3N/3N9R-TD3/3N9R-TD3_target.pdbqt | data/3N/3N9R-TD3/3N9R-TD3_decoys.pdbqt | data/3N/3N9R-TD3/3N9R-TD3_decoy_scores.csv |
3NQE-BMP | data/3N/3NQE-BMP/3NQE-BMP_ligand.pdbqt | data/3N/3NQE-BMP/3NQE-BMP_target.pdbqt | data/3N/3NQE-BMP/3NQE-BMP_decoys.pdbqt | data/3N/3NQE-BMP/3NQE-BMP_decoy_scores.csv |
3NQA-BMP | data/3N/3NQA-BMP/3NQA-BMP_ligand.pdbqt | data/3N/3NQA-BMP/3NQA-BMP_target.pdbqt | data/3N/3NQA-BMP/3NQA-BMP_decoys.pdbqt | data/3N/3NQA-BMP/3NQA-BMP_decoy_scores.csv |
3NUY-JPZ | data/3N/3NUY-JPZ/3NUY-JPZ_ligand.pdbqt | data/3N/3NUY-JPZ/3NUY-JPZ_target.pdbqt | data/3N/3NUY-JPZ/3NUY-JPZ_decoys.pdbqt | data/3N/3NUY-JPZ/3NUY-JPZ_decoy_scores.csv |
3NFI-PE4 | data/3N/3NFI-PE4/3NFI-PE4_ligand.pdbqt | data/3N/3NFI-PE4/3NFI-PE4_target.pdbqt | data/3N/3NFI-PE4/3NFI-PE4_decoys.pdbqt | data/3N/3NFI-PE4/3NFI-PE4_decoy_scores.csv |
3NRB-FLC | data/3N/3NRB-FLC/3NRB-FLC_ligand.pdbqt | data/3N/3NRB-FLC/3NRB-FLC_target.pdbqt | data/3N/3NRB-FLC/3NRB-FLC_decoys.pdbqt | data/3N/3NRB-FLC/3NRB-FLC_decoy_scores.csv |
3NLX-H4B | data/3N/3NLX-H4B/3NLX-H4B_ligand.pdbqt | data/3N/3NLX-H4B/3NLX-H4B_target.pdbqt | data/3N/3NLX-H4B/3NLX-H4B_decoys.pdbqt | data/3N/3NLX-H4B/3NLX-H4B_decoy_scores.csv |
3NBF-8OD | data/3N/3NBF-8OD/3NBF-8OD_ligand.pdbqt | data/3N/3NBF-8OD/3NBF-8OD_target.pdbqt | data/3N/3NBF-8OD/3NBF-8OD_decoys.pdbqt | data/3N/3NBF-8OD/3NBF-8OD_decoy_scores.csv |
3NVD-OAN | data/3N/3NVD-OAN/3NVD-OAN_ligand.pdbqt | data/3N/3NVD-OAN/3NVD-OAN_target.pdbqt | data/3N/3NVD-OAN/3NVD-OAN_decoys.pdbqt | data/3N/3NVD-OAN/3NVD-OAN_decoy_scores.csv |
3NHX-ASD | data/3N/3NHX-ASD/3NHX-ASD_ligand.pdbqt | data/3N/3NHX-ASD/3NHX-ASD_target.pdbqt | data/3N/3NHX-ASD/3NHX-ASD_decoys.pdbqt | data/3N/3NHX-ASD/3NHX-ASD_decoy_scores.csv |
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