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 ⌀ |
|---|---|---|---|---|
4NRQ-PD2 | data/4N/4NRQ-PD2/4NRQ-PD2_ligand.pdbqt | data/4N/4NRQ-PD2/4NRQ-PD2_target.pdbqt | data/4N/4NRQ-PD2/4NRQ-PD2_decoys.pdbqt | data/4N/4NRQ-PD2/4NRQ-PD2_decoy_scores.csv |
4NDO-ATP | data/4N/4NDO-ATP/4NDO-ATP_ligand.pdbqt | data/4N/4NDO-ATP/4NDO-ATP_target.pdbqt | null | null |
4N54-2H3 | data/4N/4N54-2H3/4N54-2H3_ligand.pdbqt | data/4N/4N54-2H3/4N54-2H3_target.pdbqt | data/4N/4N54-2H3/4N54-2H3_decoys.pdbqt | data/4N/4N54-2H3/4N54-2H3_decoy_scores.csv |
4NON-GDP | data/4N/4NON-GDP/4NON-GDP_ligand.pdbqt | data/4N/4NON-GDP/4NON-GDP_target.pdbqt | data/4N/4NON-GDP/4NON-GDP_decoys.pdbqt | data/4N/4NON-GDP/4NON-GDP_decoy_scores.csv |
4NZ9-1JT | data/4N/4NZ9-1JT/4NZ9-1JT_ligand.pdbqt | data/4N/4NZ9-1JT/4NZ9-1JT_target.pdbqt | data/4N/4NZ9-1JT/4NZ9-1JT_decoys.pdbqt | data/4N/4NZ9-1JT/4NZ9-1JT_decoy_scores.csv |
4NV0-MG7 | data/4N/4NV0-MG7/4NV0-MG7_ligand.pdbqt | data/4N/4NV0-MG7/4NV0-MG7_target.pdbqt | data/4N/4NV0-MG7/4NV0-MG7_decoys.pdbqt | data/4N/4NV0-MG7/4NV0-MG7_decoy_scores.csv |
4NCS-FSR | data/4N/4NCS-FSR/4NCS-FSR_ligand.pdbqt | data/4N/4NCS-FSR/4NCS-FSR_target.pdbqt | data/4N/4NCS-FSR/4NCS-FSR_decoys.pdbqt | data/4N/4NCS-FSR/4NCS-FSR_decoy_scores.csv |
4N9I-PCG | data/4N/4N9I-PCG/4N9I-PCG_ligand.pdbqt | data/4N/4N9I-PCG/4N9I-PCG_target.pdbqt | data/4N/4N9I-PCG/4N9I-PCG_decoys.pdbqt | data/4N/4N9I-PCG/4N9I-PCG_decoy_scores.csv |
4NXU-ADP | data/4N/4NXU-ADP/4NXU-ADP_ligand.pdbqt | data/4N/4NXU-ADP/4NXU-ADP_target.pdbqt | data/4N/4NXU-ADP/4NXU-ADP_decoys.pdbqt | data/4N/4NXU-ADP/4NXU-ADP_decoy_scores.csv |
4NMF-2L3 | data/4N/4NMF-2L3/4NMF-2L3_ligand.pdbqt | data/4N/4NMF-2L3/4NMF-2L3_target.pdbqt | data/4N/4NMF-2L3/4NMF-2L3_decoys.pdbqt | data/4N/4NMF-2L3/4NMF-2L3_decoy_scores.csv |
4N6W-FLC | data/4N/4N6W-FLC/4N6W-FLC_ligand.pdbqt | data/4N/4N6W-FLC/4N6W-FLC_target.pdbqt | data/4N/4N6W-FLC/4N6W-FLC_decoys.pdbqt | data/4N/4N6W-FLC/4N6W-FLC_decoy_scores.csv |
4NVN-2O1 | data/4N/4NVN-2O1/4NVN-2O1_ligand.pdbqt | data/4N/4NVN-2O1/4NVN-2O1_target.pdbqt | data/4N/4NVN-2O1/4NVN-2O1_decoys.pdbqt | data/4N/4NVN-2O1/4NVN-2O1_decoy_scores.csv |
4N1R-WM3 | data/4N/4N1R-WM3/4N1R-WM3_ligand.pdbqt | data/4N/4N1R-WM3/4N1R-WM3_target.pdbqt | data/4N/4N1R-WM3/4N1R-WM3_decoys.pdbqt | data/4N/4N1R-WM3/4N1R-WM3_decoy_scores.csv |
4N8Q-FA0 | data/4N/4N8Q-FA0/4N8Q-FA0_ligand.pdbqt | data/4N/4N8Q-FA0/4N8Q-FA0_target.pdbqt | data/4N/4N8Q-FA0/4N8Q-FA0_decoys.pdbqt | data/4N/4N8Q-FA0/4N8Q-FA0_decoy_scores.csv |
4N87-GBJ | data/4N/4N87-GBJ/4N87-GBJ_ligand.pdbqt | data/4N/4N87-GBJ/4N87-GBJ_target.pdbqt | data/4N/4N87-GBJ/4N87-GBJ_decoys.pdbqt | data/4N/4N87-GBJ/4N87-GBJ_decoy_scores.csv |
4NF1-NLG | data/4N/4NF1-NLG/4NF1-NLG_ligand.pdbqt | data/4N/4NF1-NLG/4NF1-NLG_target.pdbqt | data/4N/4NF1-NLG/4NF1-NLG_decoys.pdbqt | data/4N/4NF1-NLG/4NF1-NLG_decoy_scores.csv |
4ND3-NAD | data/4N/4ND3-NAD/4ND3-NAD_ligand.pdbqt | data/4N/4ND3-NAD/4ND3-NAD_target.pdbqt | data/4N/4ND3-NAD/4ND3-NAD_decoys.pdbqt | data/4N/4ND3-NAD/4ND3-NAD_decoy_scores.csv |
4N1S-WM4 | data/4N/4N1S-WM4/4N1S-WM4_ligand.pdbqt | data/4N/4N1S-WM4/4N1S-WM4_target.pdbqt | data/4N/4N1S-WM4/4N1S-WM4_decoys.pdbqt | data/4N/4N1S-WM4/4N1S-WM4_decoy_scores.csv |
4N8Z-BEN | data/4N/4N8Z-BEN/4N8Z-BEN_ligand.pdbqt | data/4N/4N8Z-BEN/4N8Z-BEN_target.pdbqt | data/4N/4N8Z-BEN/4N8Z-BEN_decoys.pdbqt | data/4N/4N8Z-BEN/4N8Z-BEN_decoy_scores.csv |
4NE0-ZZU | data/4N/4NE0-ZZU/4NE0-ZZU_ligand.pdbqt | data/4N/4NE0-ZZU/4NE0-ZZU_target.pdbqt | data/4N/4NE0-ZZU/4NE0-ZZU_decoys.pdbqt | data/4N/4NE0-ZZU/4NE0-ZZU_decoy_scores.csv |
4NJD-NJD | data/4N/4NJD-NJD/4NJD-NJD_ligand.pdbqt | data/4N/4NJD-NJD/4NJD-NJD_target.pdbqt | data/4N/4NJD-NJD/4NJD-NJD_decoys.pdbqt | data/4N/4NJD-NJD/4NJD-NJD_decoy_scores.csv |
4NOG-BTB | data/4N/4NOG-BTB/4NOG-BTB_ligand.pdbqt | data/4N/4NOG-BTB/4NOG-BTB_target.pdbqt | data/4N/4NOG-BTB/4NOG-BTB_decoys.pdbqt | data/4N/4NOG-BTB/4NOG-BTB_decoy_scores.csv |
4NTM-2K8 | data/4N/4NTM-2K8/4NTM-2K8_ligand.pdbqt | data/4N/4NTM-2K8/4NTM-2K8_target.pdbqt | data/4N/4NTM-2K8/4NTM-2K8_decoys.pdbqt | data/4N/4NTM-2K8/4NTM-2K8_decoy_scores.csv |
4NSI-FLC | data/4N/4NSI-FLC/4NSI-FLC_ligand.pdbqt | data/4N/4NSI-FLC/4NSI-FLC_target.pdbqt | null | null |
4NUS-2NK | data/4N/4NUS-2NK/4NUS-2NK_ligand.pdbqt | data/4N/4NUS-2NK/4NUS-2NK_target.pdbqt | data/4N/4NUS-2NK/4NUS-2NK_decoys.pdbqt | data/4N/4NUS-2NK/4NUS-2NK_decoy_scores.csv |
4N98-4FC | data/4N/4N98-4FC/4N98-4FC_ligand.pdbqt | data/4N/4N98-4FC/4N98-4FC_target.pdbqt | data/4N/4N98-4FC/4N98-4FC_decoys.pdbqt | data/4N/4N98-4FC/4N98-4FC_decoy_scores.csv |
4NVG-2N9 | data/4N/4NVG-2N9/4NVG-2N9_ligand.pdbqt | data/4N/4NVG-2N9/4NVG-2N9_target.pdbqt | data/4N/4NVG-2N9/4NVG-2N9_decoys.pdbqt | data/4N/4NVG-2N9/4NVG-2N9_decoy_scores.csv |
4NB4-ADP | data/4N/4NB4-ADP/4NB4-ADP_ligand.pdbqt | data/4N/4NB4-ADP/4NB4-ADP_target.pdbqt | data/4N/4NB4-ADP/4NB4-ADP_decoys.pdbqt | data/4N/4NB4-ADP/4NB4-ADP_decoy_scores.csv |
4N6H-EJ4 | data/4N/4N6H-EJ4/4N6H-EJ4_ligand.pdbqt | data/4N/4N6H-EJ4/4N6H-EJ4_target.pdbqt | data/4N/4N6H-EJ4/4N6H-EJ4_decoys.pdbqt | data/4N/4N6H-EJ4/4N6H-EJ4_decoy_scores.csv |
4NB5-2JT | data/4N/4NB5-2JT/4NB5-2JT_ligand.pdbqt | data/4N/4NB5-2JT/4NB5-2JT_target.pdbqt | data/4N/4NB5-2JT/4NB5-2JT_decoys.pdbqt | data/4N/4NB5-2JT/4NB5-2JT_decoy_scores.csv |
4NM3-ADP | data/4N/4NM3-ADP/4NM3-ADP_ligand.pdbqt | data/4N/4NM3-ADP/4NM3-ADP_target.pdbqt | data/4N/4NM3-ADP/4NM3-ADP_decoys.pdbqt | data/4N/4NM3-ADP/4NM3-ADP_decoy_scores.csv |
4NFD-SIA | data/4N/4NFD-SIA/4NFD-SIA_ligand.pdbqt | data/4N/4NFD-SIA/4NFD-SIA_target.pdbqt | data/4N/4NFD-SIA/4NFD-SIA_decoys.pdbqt | data/4N/4NFD-SIA/4NFD-SIA_decoy_scores.csv |
4NY7-PQQ | data/4N/4NY7-PQQ/4NY7-PQQ_ligand.pdbqt | data/4N/4NY7-PQQ/4NY7-PQQ_target.pdbqt | data/4N/4NY7-PQQ/4NY7-PQQ_decoys.pdbqt | data/4N/4NY7-PQQ/4NY7-PQQ_decoy_scores.csv |
4N49-MGT | data/4N/4N49-MGT/4N49-MGT_ligand.pdbqt | data/4N/4N49-MGT/4N49-MGT_target.pdbqt | data/4N/4N49-MGT/4N49-MGT_decoys.pdbqt | data/4N/4N49-MGT/4N49-MGT_decoy_scores.csv |
4NU5-NAD | data/4N/4NU5-NAD/4NU5-NAD_ligand.pdbqt | data/4N/4NU5-NAD/4NU5-NAD_target.pdbqt | data/4N/4NU5-NAD/4NU5-NAD_decoys.pdbqt | data/4N/4NU5-NAD/4NU5-NAD_decoy_scores.csv |
4N6D-I3C | data/4N/4N6D-I3C/4N6D-I3C_ligand.pdbqt | data/4N/4N6D-I3C/4N6D-I3C_target.pdbqt | data/4N/4N6D-I3C/4N6D-I3C_decoys.pdbqt | data/4N/4N6D-I3C/4N6D-I3C_decoy_scores.csv |
4N5I-2HD | data/4N/4N5I-2HD/4N5I-2HD_ligand.pdbqt | data/4N/4N5I-2HD/4N5I-2HD_target.pdbqt | data/4N/4N5I-2HD/4N5I-2HD_decoys.pdbqt | data/4N/4N5I-2HD/4N5I-2HD_decoy_scores.csv |
4NDU-AMG | data/4N/4NDU-AMG/4NDU-AMG_ligand.pdbqt | data/4N/4NDU-AMG/4NDU-AMG_target.pdbqt | data/4N/4NDU-AMG/4NDU-AMG_decoys.pdbqt | data/4N/4NDU-AMG/4NDU-AMG_decoy_scores.csv |
4NXE-FMN | data/4N/4NXE-FMN/4NXE-FMN_ligand.pdbqt | data/4N/4NXE-FMN/4NXE-FMN_target.pdbqt | data/4N/4NXE-FMN/4NXE-FMN_decoys.pdbqt | data/4N/4NXE-FMN/4NXE-FMN_decoy_scores.csv |
4NZM-ANP | data/4N/4NZM-ANP/4NZM-ANP_ligand.pdbqt | data/4N/4NZM-ANP/4NZM-ANP_target.pdbqt | data/4N/4NZM-ANP/4NZM-ANP_decoys.pdbqt | data/4N/4NZM-ANP/4NZM-ANP_decoy_scores.csv |
4NR7-2LO | data/4N/4NR7-2LO/4NR7-2LO_ligand.pdbqt | data/4N/4NR7-2LO/4NR7-2LO_target.pdbqt | data/4N/4NR7-2LO/4NR7-2LO_decoys.pdbqt | data/4N/4NR7-2LO/4NR7-2LO_decoy_scores.csv |
4N02-FNR | data/4N/4N02-FNR/4N02-FNR_ligand.pdbqt | data/4N/4N02-FNR/4N02-FNR_target.pdbqt | data/4N/4N02-FNR/4N02-FNR_decoys.pdbqt | data/4N/4N02-FNR/4N02-FNR_decoy_scores.csv |
4NFI-JD5 | data/4N/4NFI-JD5/4NFI-JD5_ligand.pdbqt | data/4N/4NFI-JD5/4NFI-JD5_target.pdbqt | data/4N/4NFI-JD5/4NFI-JD5_decoys.pdbqt | data/4N/4NFI-JD5/4NFI-JD5_decoy_scores.csv |
4NXF-FMN | data/4N/4NXF-FMN/4NXF-FMN_ligand.pdbqt | data/4N/4NXF-FMN/4NXF-FMN_target.pdbqt | data/4N/4NXF-FMN/4NXF-FMN_decoys.pdbqt | data/4N/4NXF-FMN/4NXF-FMN_decoy_scores.csv |
4NM7-ADP | data/4N/4NM7-ADP/4NM7-ADP_ligand.pdbqt | data/4N/4NM7-ADP/4NM7-ADP_target.pdbqt | data/4N/4NM7-ADP/4NM7-ADP_decoys.pdbqt | data/4N/4NM7-ADP/4NM7-ADP_decoy_scores.csv |
4N0E-GDP | data/4N/4N0E-GDP/4N0E-GDP_ligand.pdbqt | data/4N/4N0E-GDP/4N0E-GDP_target.pdbqt | data/4N/4N0E-GDP/4N0E-GDP_decoys.pdbqt | data/4N/4N0E-GDP/4N0E-GDP_decoy_scores.csv |
4NFH-NAJ | data/4N/4NFH-NAJ/4NFH-NAJ_ligand.pdbqt | data/4N/4NFH-NAJ/4NFH-NAJ_target.pdbqt | data/4N/4NFH-NAJ/4NFH-NAJ_decoys.pdbqt | data/4N/4NFH-NAJ/4NFH-NAJ_decoy_scores.csv |
4N4L-HG1 | data/4N/4N4L-HG1/4N4L-HG1_ligand.pdbqt | data/4N/4N4L-HG1/4N4L-HG1_target.pdbqt | data/4N/4N4L-HG1/4N4L-HG1_decoys.pdbqt | data/4N/4N4L-HG1/4N4L-HG1_decoy_scores.csv |
4N1F-CZH | data/4N/4N1F-CZH/4N1F-CZH_ligand.pdbqt | data/4N/4N1F-CZH/4N1F-CZH_target.pdbqt | data/4N/4N1F-CZH/4N1F-CZH_decoys.pdbqt | data/4N/4N1F-CZH/4N1F-CZH_decoy_scores.csv |
4N00-2EX | data/4N/4N00-2EX/4N00-2EX_ligand.pdbqt | data/4N/4N00-2EX/4N00-2EX_target.pdbqt | data/4N/4N00-2EX/4N00-2EX_decoys.pdbqt | data/4N/4N00-2EX/4N00-2EX_decoy_scores.csv |
4NBJ-D3Y | data/4N/4NBJ-D3Y/4NBJ-D3Y_ligand.pdbqt | data/4N/4NBJ-D3Y/4NBJ-D3Y_target.pdbqt | data/4N/4NBJ-D3Y/4NBJ-D3Y_decoys.pdbqt | data/4N/4NBJ-D3Y/4NBJ-D3Y_decoy_scores.csv |
4NYF-4BI | data/4N/4NYF-4BI/4NYF-4BI_ligand.pdbqt | data/4N/4NYF-4BI/4NYF-4BI_target.pdbqt | data/4N/4NYF-4BI/4NYF-4BI_decoys.pdbqt | data/4N/4NYF-4BI/4NYF-4BI_decoy_scores.csv |
4N4D-XX8 | data/4N/4N4D-XX8/4N4D-XX8_ligand.pdbqt | data/4N/4N4D-XX8/4N4D-XX8_target.pdbqt | data/4N/4N4D-XX8/4N4D-XX8_decoys.pdbqt | data/4N/4N4D-XX8/4N4D-XX8_decoy_scores.csv |
4N7G-P6G | data/4N/4N7G-P6G/4N7G-P6G_ligand.pdbqt | data/4N/4N7G-P6G/4N7G-P6G_target.pdbqt | data/4N/4N7G-P6G/4N7G-P6G_decoys.pdbqt | data/4N/4N7G-P6G/4N7G-P6G_decoy_scores.csv |
4N4O-12P | data/4N/4N4O-12P/4N4O-12P_ligand.pdbqt | data/4N/4N4O-12P/4N4O-12P_target.pdbqt | data/4N/4N4O-12P/4N4O-12P_decoys.pdbqt | data/4N/4N4O-12P/4N4O-12P_decoy_scores.csv |
4NHV-2O6 | data/4N/4NHV-2O6/4NHV-2O6_ligand.pdbqt | data/4N/4NHV-2O6/4NHV-2O6_target.pdbqt | data/4N/4NHV-2O6/4NHV-2O6_decoys.pdbqt | data/4N/4NHV-2O6/4NHV-2O6_decoy_scores.csv |
4N9S-8HX | data/4N/4N9S-8HX/4N9S-8HX_ligand.pdbqt | data/4N/4N9S-8HX/4N9S-8HX_target.pdbqt | null | null |
4N1T-2GD | data/4N/4N1T-2GD/4N1T-2GD_ligand.pdbqt | data/4N/4N1T-2GD/4N1T-2GD_target.pdbqt | data/4N/4N1T-2GD/4N1T-2GD_decoys.pdbqt | data/4N/4N1T-2GD/4N1T-2GD_decoy_scores.csv |
4N9E-2HL | data/4N/4N9E-2HL/4N9E-2HL_ligand.pdbqt | data/4N/4N9E-2HL/4N9E-2HL_target.pdbqt | data/4N/4N9E-2HL/4N9E-2HL_decoys.pdbqt | data/4N/4N9E-2HL/4N9E-2HL_decoy_scores.csv |
4NSE-ARG | data/4N/4NSE-ARG/4NSE-ARG_ligand.pdbqt | data/4N/4NSE-ARG/4NSE-ARG_target.pdbqt | data/4N/4NSE-ARG/4NSE-ARG_decoys.pdbqt | data/4N/4NSE-ARG/4NSE-ARG_decoy_scores.csv |
4N3U-FLC | data/4N/4N3U-FLC/4N3U-FLC_ligand.pdbqt | data/4N/4N3U-FLC/4N3U-FLC_target.pdbqt | data/4N/4N3U-FLC/4N3U-FLC_decoys.pdbqt | data/4N/4N3U-FLC/4N3U-FLC_decoy_scores.csv |
4NEM-2JY | data/4N/4NEM-2JY/4NEM-2JY_ligand.pdbqt | data/4N/4NEM-2JY/4NEM-2JY_target.pdbqt | data/4N/4NEM-2JY/4NEM-2JY_decoys.pdbqt | data/4N/4NEM-2JY/4NEM-2JY_decoy_scores.csv |
4NFJ-JD5 | data/4N/4NFJ-JD5/4NFJ-JD5_ligand.pdbqt | data/4N/4NFJ-JD5/4NFJ-JD5_target.pdbqt | data/4N/4NFJ-JD5/4NFJ-JD5_decoys.pdbqt | data/4N/4NFJ-JD5/4NFJ-JD5_decoy_scores.csv |
4N4D-P33 | data/4N/4N4D-P33/4N4D-P33_ligand.pdbqt | data/4N/4N4D-P33/4N4D-P33_target.pdbqt | data/4N/4N4D-P33/4N4D-P33_decoys.pdbqt | data/4N/4N4D-P33/4N4D-P33_decoy_scores.csv |
4NE2-ADP | data/4N/4NE2-ADP/4NE2-ADP_ligand.pdbqt | data/4N/4NE2-ADP/4NE2-ADP_target.pdbqt | data/4N/4NE2-ADP/4NE2-ADP_decoys.pdbqt | data/4N/4NE2-ADP/4NE2-ADP_decoy_scores.csv |
4NG5-PFB | data/4N/4NG5-PFB/4NG5-PFB_ligand.pdbqt | data/4N/4NG5-PFB/4NG5-PFB_target.pdbqt | data/4N/4NG5-PFB/4NG5-PFB_decoys.pdbqt | data/4N/4NG5-PFB/4NG5-PFB_decoy_scores.csv |
4N9P-THP | data/4N/4N9P-THP/4N9P-THP_ligand.pdbqt | data/4N/4N9P-THP/4N9P-THP_target.pdbqt | data/4N/4N9P-THP/4N9P-THP_decoys.pdbqt | data/4N/4N9P-THP/4N9P-THP_decoy_scores.csv |
4NCZ-NHE | data/4N/4NCZ-NHE/4NCZ-NHE_ligand.pdbqt | data/4N/4NCZ-NHE/4NCZ-NHE_target.pdbqt | data/4N/4NCZ-NHE/4NCZ-NHE_decoys.pdbqt | data/4N/4NCZ-NHE/4NCZ-NHE_decoy_scores.csv |
4N67-ADP | data/4N/4N67-ADP/4N67-ADP_ligand.pdbqt | data/4N/4N67-ADP/4N67-ADP_target.pdbqt | data/4N/4N67-ADP/4N67-ADP_decoys.pdbqt | data/4N/4N67-ADP/4N67-ADP_decoy_scores.csv |
4NE2-SH2 | data/4N/4NE2-SH2/4NE2-SH2_ligand.pdbqt | data/4N/4NE2-SH2/4NE2-SH2_target.pdbqt | data/4N/4NE2-SH2/4NE2-SH2_decoys.pdbqt | data/4N/4NE2-SH2/4NE2-SH2_decoy_scores.csv |
4NDX-THP | data/4N/4NDX-THP/4NDX-THP_ligand.pdbqt | data/4N/4NDX-THP/4NDX-THP_target.pdbqt | data/4N/4NDX-THP/4NDX-THP_decoys.pdbqt | data/4N/4NDX-THP/4NDX-THP_decoy_scores.csv |
4NJI-SAM | data/4N/4NJI-SAM/4NJI-SAM_ligand.pdbqt | data/4N/4NJI-SAM/4NJI-SAM_target.pdbqt | data/4N/4NJI-SAM/4NJI-SAM_decoys.pdbqt | data/4N/4NJI-SAM/4NJI-SAM_decoy_scores.csv |
4NJM-3PG | data/4N/4NJM-3PG/4NJM-3PG_ligand.pdbqt | data/4N/4NJM-3PG/4NJM-3PG_target.pdbqt | data/4N/4NJM-3PG/4NJM-3PG_decoys.pdbqt | data/4N/4NJM-3PG/4NJM-3PG_decoy_scores.csv |
4NFU-BGC | data/4N/4NFU-BGC/4NFU-BGC_ligand.pdbqt | data/4N/4NFU-BGC/4NFU-BGC_target.pdbqt | data/4N/4NFU-BGC/4NFU-BGC_decoys.pdbqt | data/4N/4NFU-BGC/4NFU-BGC_decoy_scores.csv |
4NM5-ADP | data/4N/4NM5-ADP/4NM5-ADP_ligand.pdbqt | data/4N/4NM5-ADP/4NM5-ADP_target.pdbqt | data/4N/4NM5-ADP/4NM5-ADP_decoys.pdbqt | data/4N/4NM5-ADP/4NM5-ADP_decoy_scores.csv |
4NBD-9CA | data/4N/4NBD-9CA/4NBD-9CA_ligand.pdbqt | data/4N/4NBD-9CA/4NBD-9CA_target.pdbqt | data/4N/4NBD-9CA/4NBD-9CA_decoys.pdbqt | data/4N/4NBD-9CA/4NBD-9CA_decoy_scores.csv |
4NKE-IPE | data/4N/4NKE-IPE/4NKE-IPE_ligand.pdbqt | data/4N/4NKE-IPE/4NKE-IPE_target.pdbqt | data/4N/4NKE-IPE/4NKE-IPE_decoys.pdbqt | data/4N/4NKE-IPE/4NKE-IPE_decoy_scores.csv |
4N6H-OLA | data/4N/4N6H-OLA/4N6H-OLA_ligand.pdbqt | data/4N/4N6H-OLA/4N6H-OLA_target.pdbqt | data/4N/4N6H-OLA/4N6H-OLA_decoys.pdbqt | data/4N/4N6H-OLA/4N6H-OLA_decoy_scores.csv |
4NJA-2M9 | data/4N/4NJA-2M9/4NJA-2M9_ligand.pdbqt | data/4N/4NJA-2M9/4NJA-2M9_target.pdbqt | data/4N/4NJA-2M9/4NJA-2M9_decoys.pdbqt | data/4N/4NJA-2M9/4NJA-2M9_decoy_scores.csv |
4NL1-Z13 | data/4N/4NL1-Z13/4NL1-Z13_ligand.pdbqt | data/4N/4NL1-Z13/4NL1-Z13_target.pdbqt | data/4N/4NL1-Z13/4NL1-Z13_decoys.pdbqt | data/4N/4NL1-Z13/4NL1-Z13_decoy_scores.csv |
4NR4-2LK | data/4N/4NR4-2LK/4NR4-2LK_ligand.pdbqt | data/4N/4NR4-2LK/4NR4-2LK_target.pdbqt | data/4N/4NR4-2LK/4NR4-2LK_decoys.pdbqt | data/4N/4NR4-2LK/4NR4-2LK_decoy_scores.csv |
4NRT-2NG | data/4N/4NRT-2NG/4NRT-2NG_ligand.pdbqt | data/4N/4NRT-2NG/4NRT-2NG_target.pdbqt | data/4N/4NRT-2NG/4NRT-2NG_decoys.pdbqt | data/4N/4NRT-2NG/4NRT-2NG_decoy_scores.csv |
4N96-6NI | data/4N/4N96-6NI/4N96-6NI_ligand.pdbqt | data/4N/4N96-6NI/4N96-6NI_target.pdbqt | data/4N/4N96-6NI/4N96-6NI_decoys.pdbqt | data/4N/4N96-6NI/4N96-6NI_decoy_scores.csv |
4N4S-2H1 | data/4N/4N4S-2H1/4N4S-2H1_ligand.pdbqt | data/4N/4N4S-2H1/4N4S-2H1_target.pdbqt | data/4N/4N4S-2H1/4N4S-2H1_decoys.pdbqt | data/4N/4N4S-2H1/4N4S-2H1_decoy_scores.csv |
4NQ5-3C7 | data/4N/4NQ5-3C7/4NQ5-3C7_ligand.pdbqt | data/4N/4NQ5-3C7/4NQ5-3C7_target.pdbqt | data/4N/4NQ5-3C7/4NQ5-3C7_decoys.pdbqt | data/4N/4NQ5-3C7/4NQ5-3C7_decoy_scores.csv |
4NG5-NAJ | data/4N/4NG5-NAJ/4NG5-NAJ_ligand.pdbqt | data/4N/4NG5-NAJ/4NG5-NAJ_target.pdbqt | data/4N/4NG5-NAJ/4NG5-NAJ_decoys.pdbqt | data/4N/4NG5-NAJ/4NG5-NAJ_decoy_scores.csv |
4NJT-017 | data/4N/4NJT-017/4NJT-017_ligand.pdbqt | data/4N/4NJT-017/4NJT-017_target.pdbqt | data/4N/4NJT-017/4NJT-017_decoys.pdbqt | data/4N/4NJT-017/4NJT-017_decoy_scores.csv |
4NSY-2OY | data/4N/4NSY-2OY/4NSY-2OY_ligand.pdbqt | data/4N/4NSY-2OY/4NSY-2OY_target.pdbqt | data/4N/4NSY-2OY/4NSY-2OY_decoys.pdbqt | data/4N/4NSY-2OY/4NSY-2OY_decoy_scores.csv |
4N9T-THP | data/4N/4N9T-THP/4N9T-THP_ligand.pdbqt | data/4N/4N9T-THP/4N9T-THP_target.pdbqt | data/4N/4N9T-THP/4N9T-THP_decoys.pdbqt | data/4N/4N9T-THP/4N9T-THP_decoy_scores.csv |
4NDP-ATP | data/4N/4NDP-ATP/4NDP-ATP_ligand.pdbqt | data/4N/4NDP-ATP/4NDP-ATP_target.pdbqt | null | null |
4NNT-76D | data/4N/4NNT-76D/4NNT-76D_ligand.pdbqt | data/4N/4NNT-76D/4NNT-76D_target.pdbqt | data/4N/4NNT-76D/4NNT-76D_decoys.pdbqt | data/4N/4NNT-76D/4NNT-76D_decoy_scores.csv |
4NQ8-PAF | data/4N/4NQ8-PAF/4NQ8-PAF_ligand.pdbqt | data/4N/4NQ8-PAF/4NQ8-PAF_target.pdbqt | data/4N/4NQ8-PAF/4NQ8-PAF_decoys.pdbqt | data/4N/4NQ8-PAF/4NQ8-PAF_decoy_scores.csv |
4NAP-DTR | data/4N/4NAP-DTR/4NAP-DTR_ligand.pdbqt | data/4N/4NAP-DTR/4NAP-DTR_target.pdbqt | data/4N/4NAP-DTR/4NAP-DTR_decoys.pdbqt | data/4N/4NAP-DTR/4NAP-DTR_decoy_scores.csv |
4NI0-2P3 | data/4N/4NI0-2P3/4NI0-2P3_ligand.pdbqt | data/4N/4NI0-2P3/4NI0-2P3_target.pdbqt | data/4N/4NI0-2P3/4NI0-2P3_decoys.pdbqt | data/4N/4NI0-2P3/4NI0-2P3_decoy_scores.csv |
4N65-AQN | data/4N/4N65-AQN/4N65-AQN_ligand.pdbqt | data/4N/4N65-AQN/4N65-AQN_target.pdbqt | data/4N/4N65-AQN/4N65-AQN_decoys.pdbqt | data/4N/4N65-AQN/4N65-AQN_decoy_scores.csv |
4NEX-NLG | data/4N/4NEX-NLG/4NEX-NLG_ligand.pdbqt | data/4N/4NEX-NLG/4NEX-NLG_target.pdbqt | data/4N/4NEX-NLG/4NEX-NLG_decoys.pdbqt | data/4N/4NEX-NLG/4NEX-NLG_decoy_scores.csv |
4N6H-OLC | data/4N/4N6H-OLC/4N6H-OLC_ligand.pdbqt | data/4N/4N6H-OLC/4N6H-OLC_target.pdbqt | data/4N/4N6H-OLC/4N6H-OLC_decoys.pdbqt | data/4N/4N6H-OLC/4N6H-OLC_decoy_scores.csv |
4NZO-2OV | data/4N/4NZO-2OV/4NZO-2OV_ligand.pdbqt | data/4N/4NZO-2OV/4NZO-2OV_target.pdbqt | data/4N/4NZO-2OV/4NZO-2OV_decoys.pdbqt | data/4N/4NZO-2OV/4NZO-2OV_decoy_scores.csv |
4NVQ-SAH | data/4N/4NVQ-SAH/4NVQ-SAH_ligand.pdbqt | data/4N/4NVQ-SAH/4NVQ-SAH_target.pdbqt | data/4N/4NVQ-SAH/4NVQ-SAH_decoys.pdbqt | data/4N/4NVQ-SAH/4NVQ-SAH_decoy_scores.csv |
4NOS-H4B | data/4N/4NOS-H4B/4NOS-H4B_ligand.pdbqt | data/4N/4NOS-H4B/4NOS-H4B_target.pdbqt | data/4N/4NOS-H4B/4NOS-H4B_decoys.pdbqt | data/4N/4NOS-H4B/4NOS-H4B_decoy_scores.csv |
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