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 ⌀ |
|---|---|---|---|---|
2E87-GDP | data/2E/2E87-GDP/2E87-GDP_ligand.pdbqt | data/2E/2E87-GDP/2E87-GDP_target.pdbqt | data/2E/2E87-GDP/2E87-GDP_decoys.pdbqt | data/2E/2E87-GDP/2E87-GDP_decoy_scores.csv |
2EU3-FF3 | data/2E/2EU3-FF3/2EU3-FF3_ligand.pdbqt | data/2E/2EU3-FF3/2EU3-FF3_target.pdbqt | data/2E/2EU3-FF3/2EU3-FF3_decoys.pdbqt | data/2E/2EU3-FF3/2EU3-FF3_decoy_scores.csv |
2EJT-SAM | data/2E/2EJT-SAM/2EJT-SAM_ligand.pdbqt | data/2E/2EJT-SAM/2EJT-SAM_target.pdbqt | data/2E/2EJT-SAM/2EJT-SAM_decoys.pdbqt | data/2E/2EJT-SAM/2EJT-SAM_decoy_scores.csv |
2E6F-OXC | data/2E/2E6F-OXC/2E6F-OXC_ligand.pdbqt | data/2E/2E6F-OXC/2E6F-OXC_target.pdbqt | data/2E/2E6F-OXC/2E6F-OXC_decoys.pdbqt | data/2E/2E6F-OXC/2E6F-OXC_decoy_scores.csv |
2E40-LGC | data/2E/2E40-LGC/2E40-LGC_ligand.pdbqt | data/2E/2E40-LGC/2E40-LGC_target.pdbqt | data/2E/2E40-LGC/2E40-LGC_decoys.pdbqt | data/2E/2E40-LGC/2E40-LGC_decoy_scores.csv |
2EFE-GNH | data/2E/2EFE-GNH/2EFE-GNH_ligand.pdbqt | data/2E/2EFE-GNH/2EFE-GNH_target.pdbqt | data/2E/2EFE-GNH/2EFE-GNH_decoys.pdbqt | data/2E/2EFE-GNH/2EFE-GNH_decoy_scores.csv |
2E7F-C2F | data/2E/2E7F-C2F/2E7F-C2F_ligand.pdbqt | data/2E/2E7F-C2F/2E7F-C2F_target.pdbqt | data/2E/2E7F-C2F/2E7F-C2F_decoys.pdbqt | data/2E/2E7F-C2F/2E7F-C2F_decoy_scores.csv |
2E91-ZOL | data/2E/2E91-ZOL/2E91-ZOL_ligand.pdbqt | data/2E/2E91-ZOL/2E91-ZOL_target.pdbqt | data/2E/2E91-ZOL/2E91-ZOL_decoys.pdbqt | data/2E/2E91-ZOL/2E91-ZOL_decoy_scores.csv |
2EZ8-TDL | data/2E/2EZ8-TDL/2EZ8-TDL_ligand.pdbqt | data/2E/2EZ8-TDL/2EZ8-TDL_target.pdbqt | data/2E/2EZ8-TDL/2EZ8-TDL_decoys.pdbqt | data/2E/2EZ8-TDL/2EZ8-TDL_decoy_scores.csv |
2E8Q-SAH | data/2E/2E8Q-SAH/2E8Q-SAH_ligand.pdbqt | data/2E/2E8Q-SAH/2E8Q-SAH_target.pdbqt | data/2E/2E8Q-SAH/2E8Q-SAH_decoys.pdbqt | data/2E/2E8Q-SAH/2E8Q-SAH_decoy_scores.csv |
2E3P-16C | data/2E/2E3P-16C/2E3P-16C_ligand.pdbqt | data/2E/2E3P-16C/2E3P-16C_target.pdbqt | data/2E/2E3P-16C/2E3P-16C_decoys.pdbqt | data/2E/2E3P-16C/2E3P-16C_decoy_scores.csv |
2ESR-GLC | data/2E/2ESR-GLC/2ESR-GLC_ligand.pdbqt | data/2E/2ESR-GLC/2ESR-GLC_target.pdbqt | data/2E/2ESR-GLC/2ESR-GLC_decoys.pdbqt | data/2E/2ESR-GLC/2ESR-GLC_decoy_scores.csv |
2EUK-GAL | data/2E/2EUK-GAL/2EUK-GAL_ligand.pdbqt | data/2E/2EUK-GAL/2EUK-GAL_target.pdbqt | data/2E/2EUK-GAL/2EUK-GAL_decoys.pdbqt | data/2E/2EUK-GAL/2EUK-GAL_decoy_scores.csv |
2EVA-ADN | data/2E/2EVA-ADN/2EVA-ADN_ligand.pdbqt | data/2E/2EVA-ADN/2EVA-ADN_target.pdbqt | data/2E/2EVA-ADN/2EVA-ADN_decoys.pdbqt | data/2E/2EVA-ADN/2EVA-ADN_decoy_scores.csv |
2EC9-FUC | data/2E/2EC9-FUC/2EC9-FUC_ligand.pdbqt | data/2E/2EC9-FUC/2EC9-FUC_target.pdbqt | data/2E/2EC9-FUC/2EC9-FUC_decoys.pdbqt | data/2E/2EC9-FUC/2EC9-FUC_decoy_scores.csv |
2EJZ-SAH | data/2E/2EJZ-SAH/2EJZ-SAH_ligand.pdbqt | data/2E/2EJZ-SAH/2EJZ-SAH_target.pdbqt | data/2E/2EJZ-SAH/2EJZ-SAH_decoys.pdbqt | data/2E/2EJZ-SAH/2EJZ-SAH_decoy_scores.csv |
2EHC-SAH | data/2E/2EHC-SAH/2EHC-SAH_ligand.pdbqt | data/2E/2EHC-SAH/2EHC-SAH_target.pdbqt | data/2E/2EHC-SAH/2EHC-SAH_decoys.pdbqt | data/2E/2EHC-SAH/2EHC-SAH_decoy_scores.csv |
2E27-AB0 | data/2E/2E27-AB0/2E27-AB0_ligand.pdbqt | data/2E/2E27-AB0/2E27-AB0_target.pdbqt | data/2E/2E27-AB0/2E27-AB0_decoys.pdbqt | data/2E/2E27-AB0/2E27-AB0_decoy_scores.csv |
2EA4-F79 | data/2E/2EA4-F79/2EA4-F79_ligand.pdbqt | data/2E/2EA4-F79/2EA4-F79_target.pdbqt | data/2E/2EA4-F79/2EA4-F79_decoys.pdbqt | data/2E/2EA4-F79/2EA4-F79_decoy_scores.csv |
2EVE-MPO | data/2E/2EVE-MPO/2EVE-MPO_ligand.pdbqt | data/2E/2EVE-MPO/2EVE-MPO_target.pdbqt | data/2E/2EVE-MPO/2EVE-MPO_decoys.pdbqt | data/2E/2EVE-MPO/2EVE-MPO_decoy_scores.csv |
2E95-B75 | data/2E/2E95-B75/2E95-B75_ligand.pdbqt | data/2E/2E95-B75/2E95-B75_target.pdbqt | data/2E/2E95-B75/2E95-B75_decoys.pdbqt | data/2E/2E95-B75/2E95-B75_decoy_scores.csv |
2EI7-D93 | data/2E/2EI7-D93/2EI7-D93_ligand.pdbqt | data/2E/2EI7-D93/2EI7-D93_target.pdbqt | data/2E/2EI7-D93/2EI7-D93_decoys.pdbqt | data/2E/2EI7-D93/2EI7-D93_decoy_scores.csv |
2EWS-ANP | data/2E/2EWS-ANP/2EWS-ANP_ligand.pdbqt | data/2E/2EWS-ANP/2EWS-ANP_target.pdbqt | data/2E/2EWS-ANP/2EWS-ANP_decoys.pdbqt | data/2E/2EWS-ANP/2EWS-ANP_decoy_scores.csv |
2E37-NAD | data/2E/2E37-NAD/2E37-NAD_ligand.pdbqt | data/2E/2E37-NAD/2E37-NAD_target.pdbqt | data/2E/2E37-NAD/2E37-NAD_decoys.pdbqt | data/2E/2E37-NAD/2E37-NAD_decoy_scores.csv |
2EVL-SPH | data/2E/2EVL-SPH/2EVL-SPH_ligand.pdbqt | data/2E/2EVL-SPH/2EVL-SPH_target.pdbqt | data/2E/2EVL-SPH/2EVL-SPH_decoys.pdbqt | data/2E/2EVL-SPH/2EVL-SPH_decoy_scores.csv |
2EFH-GDP | data/2E/2EFH-GDP/2EFH-GDP_ligand.pdbqt | data/2E/2EFH-GDP/2EFH-GDP_target.pdbqt | data/2E/2EFH-GDP/2EFH-GDP_decoys.pdbqt | data/2E/2EFH-GDP/2EFH-GDP_decoy_scores.csv |
2E4R-SAH | data/2E/2E4R-SAH/2E4R-SAH_ligand.pdbqt | data/2E/2E4R-SAH/2E4R-SAH_target.pdbqt | data/2E/2E4R-SAH/2E4R-SAH_decoys.pdbqt | data/2E/2E4R-SAH/2E4R-SAH_decoy_scores.csv |
2EIL-DMU | data/2E/2EIL-DMU/2EIL-DMU_ligand.pdbqt | data/2E/2EIL-DMU/2EIL-DMU_target.pdbqt | data/2E/2EIL-DMU/2EIL-DMU_decoys.pdbqt | data/2E/2EIL-DMU/2EIL-DMU_decoy_scores.csv |
2EJK-SAH | data/2E/2EJK-SAH/2EJK-SAH_ligand.pdbqt | data/2E/2EJK-SAH/2EJK-SAH_target.pdbqt | data/2E/2EJK-SAH/2EJK-SAH_decoys.pdbqt | data/2E/2EJK-SAH/2EJK-SAH_decoy_scores.csv |
2EX8-PNM | data/2E/2EX8-PNM/2EX8-PNM_ligand.pdbqt | data/2E/2EX8-PNM/2EX8-PNM_target.pdbqt | data/2E/2EX8-PNM/2EX8-PNM_decoys.pdbqt | data/2E/2EX8-PNM/2EX8-PNM_decoy_scores.csv |
2EJ2-PPE | data/2E/2EJ2-PPE/2EJ2-PPE_ligand.pdbqt | data/2E/2EJ2-PPE/2EJ2-PPE_target.pdbqt | data/2E/2EJ2-PPE/2EJ2-PPE_decoys.pdbqt | data/2E/2EJ2-PPE/2EJ2-PPE_decoy_scores.csv |
2E89-LYS | data/2E/2E89-LYS/2E89-LYS_ligand.pdbqt | data/2E/2E89-LYS/2E89-LYS_target.pdbqt | data/2E/2E89-LYS/2E89-LYS_decoys.pdbqt | data/2E/2E89-LYS/2E89-LYS_decoy_scores.csv |
2EXM-ZIP | data/2E/2EXM-ZIP/2EXM-ZIP_ligand.pdbqt | data/2E/2EXM-ZIP/2EXM-ZIP_target.pdbqt | data/2E/2EXM-ZIP/2EXM-ZIP_decoys.pdbqt | data/2E/2EXM-ZIP/2EXM-ZIP_decoy_scores.csv |
2EPJ-PMP | data/2E/2EPJ-PMP/2EPJ-PMP_ligand.pdbqt | data/2E/2EPJ-PMP/2EPJ-PMP_target.pdbqt | data/2E/2EPJ-PMP/2EPJ-PMP_decoys.pdbqt | data/2E/2EPJ-PMP/2EPJ-PMP_decoy_scores.csv |
2EIK-DMU | data/2E/2EIK-DMU/2EIK-DMU_ligand.pdbqt | data/2E/2EIK-DMU/2EIK-DMU_target.pdbqt | data/2E/2EIK-DMU/2EIK-DMU_decoys.pdbqt | data/2E/2EIK-DMU/2EIK-DMU_decoy_scores.csv |
2E2R-2OH | data/2E/2E2R-2OH/2E2R-2OH_ligand.pdbqt | data/2E/2E2R-2OH/2E2R-2OH_target.pdbqt | data/2E/2E2R-2OH/2E2R-2OH_decoys.pdbqt | data/2E/2E2R-2OH/2E2R-2OH_decoy_scores.csv |
2EGV-SAM | data/2E/2EGV-SAM/2EGV-SAM_ligand.pdbqt | data/2E/2EGV-SAM/2EGV-SAM_target.pdbqt | data/2E/2EGV-SAM/2EGV-SAM_decoys.pdbqt | data/2E/2EGV-SAM/2EGV-SAM_decoy_scores.csv |
2EGH-FOM | data/2E/2EGH-FOM/2EGH-FOM_ligand.pdbqt | data/2E/2EGH-FOM/2EGH-FOM_target.pdbqt | data/2E/2EGH-FOM/2EGH-FOM_decoys.pdbqt | data/2E/2EGH-FOM/2EGH-FOM_decoy_scores.csv |
2EF9-A5P | data/2E/2EF9-A5P/2EF9-A5P_ligand.pdbqt | data/2E/2EF9-A5P/2EF9-A5P_target.pdbqt | data/2E/2EF9-A5P/2EF9-A5P_decoys.pdbqt | data/2E/2EF9-A5P/2EF9-A5P_decoy_scores.csv |
2E8A-ANP | data/2E/2E8A-ANP/2E8A-ANP_ligand.pdbqt | data/2E/2E8A-ANP/2E8A-ANP_target.pdbqt | data/2E/2E8A-ANP/2E8A-ANP_decoys.pdbqt | data/2E/2E8A-ANP/2E8A-ANP_decoy_scores.csv |
2EV2-OLA | data/2E/2EV2-OLA/2EV2-OLA_ligand.pdbqt | data/2E/2EV2-OLA/2EV2-OLA_target.pdbqt | data/2E/2EV2-OLA/2EV2-OLA_decoys.pdbqt | data/2E/2EV2-OLA/2EV2-OLA_decoy_scores.csv |
2EH4-SAH | data/2E/2EH4-SAH/2EH4-SAH_ligand.pdbqt | data/2E/2EH4-SAH/2EH4-SAH_target.pdbqt | data/2E/2EH4-SAH/2EH4-SAH_decoys.pdbqt | data/2E/2EH4-SAH/2EH4-SAH_decoy_scores.csv |
2E9M-OLA | data/2E/2E9M-OLA/2E9M-OLA_ligand.pdbqt | data/2E/2E9M-OLA/2E9M-OLA_target.pdbqt | data/2E/2E9M-OLA/2E9M-OLA_decoys.pdbqt | data/2E/2E9M-OLA/2E9M-OLA_decoy_scores.csv |
2E8V-GRG | data/2E/2E8V-GRG/2E8V-GRG_ligand.pdbqt | data/2E/2E8V-GRG/2E8V-GRG_target.pdbqt | data/2E/2E8V-GRG/2E8V-GRG_decoys.pdbqt | data/2E/2E8V-GRG/2E8V-GRG_decoy_scores.csv |
2E9L-PLM | data/2E/2E9L-PLM/2E9L-PLM_ligand.pdbqt | data/2E/2E9L-PLM/2E9L-PLM_target.pdbqt | data/2E/2E9L-PLM/2E9L-PLM_decoys.pdbqt | data/2E/2E9L-PLM/2E9L-PLM_decoy_scores.csv |
2EZT-TDM | data/2E/2EZT-TDM/2EZT-TDM_ligand.pdbqt | data/2E/2EZT-TDM/2EZT-TDM_target.pdbqt | data/2E/2EZT-TDM/2EZT-TDM_decoys.pdbqt | data/2E/2EZT-TDM/2EZT-TDM_decoy_scores.csv |
2ED5-SAH | data/2E/2ED5-SAH/2ED5-SAH_ligand.pdbqt | data/2E/2ED5-SAH/2ED5-SAH_target.pdbqt | data/2E/2ED5-SAH/2ED5-SAH_decoys.pdbqt | data/2E/2ED5-SAH/2ED5-SAH_decoy_scores.csv |
2E8W-IPE | data/2E/2E8W-IPE/2E8W-IPE_ligand.pdbqt | data/2E/2E8W-IPE/2E8W-IPE_target.pdbqt | data/2E/2E8W-IPE/2E8W-IPE_decoys.pdbqt | data/2E/2E8W-IPE/2E8W-IPE_decoy_scores.csv |
2EG8-FOT | data/2E/2EG8-FOT/2EG8-FOT_ligand.pdbqt | data/2E/2EG8-FOT/2EG8-FOT_target.pdbqt | data/2E/2EG8-FOT/2EG8-FOT_decoys.pdbqt | data/2E/2EG8-FOT/2EG8-FOT_decoy_scores.csv |
2E8H-SAH | data/2E/2E8H-SAH/2E8H-SAH_ligand.pdbqt | data/2E/2E8H-SAH/2E8H-SAH_target.pdbqt | data/2E/2E8H-SAH/2E8H-SAH_decoys.pdbqt | data/2E/2E8H-SAH/2E8H-SAH_decoy_scores.csv |
2EGS-SAH | data/2E/2EGS-SAH/2EGS-SAH_ligand.pdbqt | data/2E/2EGS-SAH/2EGS-SAH_target.pdbqt | data/2E/2EGS-SAH/2EGS-SAH_decoys.pdbqt | data/2E/2EGS-SAH/2EGS-SAH_decoy_scores.csv |
2ERY-GDP | data/2E/2ERY-GDP/2ERY-GDP_ligand.pdbqt | data/2E/2ERY-GDP/2ERY-GDP_target.pdbqt | data/2E/2ERY-GDP/2ERY-GDP_decoys.pdbqt | data/2E/2ERY-GDP/2ERY-GDP_decoy_scores.csv |
2EV6-FLC | data/2E/2EV6-FLC/2EV6-FLC_ligand.pdbqt | data/2E/2EV6-FLC/2EV6-FLC_target.pdbqt | data/2E/2EV6-FLC/2EV6-FLC_decoys.pdbqt | data/2E/2EV6-FLC/2EV6-FLC_decoy_scores.csv |
2EVW-XY2 | data/2E/2EVW-XY2/2EVW-XY2_ligand.pdbqt | data/2E/2EVW-XY2/2EVW-XY2_target.pdbqt | data/2E/2EVW-XY2/2EVW-XY2_decoys.pdbqt | data/2E/2EVW-XY2/2EVW-XY2_decoy_scores.csv |
2E68-FMN | data/2E/2E68-FMN/2E68-FMN_ligand.pdbqt | data/2E/2E68-FMN/2E68-FMN_target.pdbqt | data/2E/2E68-FMN/2E68-FMN_decoys.pdbqt | data/2E/2E68-FMN/2E68-FMN_decoy_scores.csv |
2EUD-ANP | data/2E/2EUD-ANP/2EUD-ANP_ligand.pdbqt | data/2E/2EUD-ANP/2EUD-ANP_target.pdbqt | data/2E/2EUD-ANP/2EUD-ANP_decoys.pdbqt | data/2E/2EUD-ANP/2EUD-ANP_decoy_scores.csv |
2EUK-SPH | data/2E/2EUK-SPH/2EUK-SPH_ligand.pdbqt | data/2E/2EUK-SPH/2EUK-SPH_target.pdbqt | data/2E/2EUK-SPH/2EUK-SPH_decoys.pdbqt | data/2E/2EUK-SPH/2EUK-SPH_decoy_scores.csv |
2EI6-D92 | data/2E/2EI6-D92/2EI6-D92_ligand.pdbqt | data/2E/2EI6-D92/2EI6-D92_target.pdbqt | data/2E/2EI6-D92/2EI6-D92_decoys.pdbqt | data/2E/2EI6-D92/2EI6-D92_decoy_scores.csv |
2EVM-FC2 | data/2E/2EVM-FC2/2EVM-FC2_ligand.pdbqt | data/2E/2EVM-FC2/2EVM-FC2_target.pdbqt | data/2E/2EVM-FC2/2EVM-FC2_decoys.pdbqt | data/2E/2EVM-FC2/2EVM-FC2_decoy_scores.csv |
2E2Q-ADP | data/2E/2E2Q-ADP/2E2Q-ADP_ligand.pdbqt | data/2E/2E2Q-ADP/2E2Q-ADP_target.pdbqt | data/2E/2E2Q-ADP/2E2Q-ADP_decoys.pdbqt | data/2E/2E2Q-ADP/2E2Q-ADP_decoy_scores.csv |
2EEQ-SAH | data/2E/2EEQ-SAH/2EEQ-SAH_ligand.pdbqt | data/2E/2EEQ-SAH/2EEQ-SAH_target.pdbqt | data/2E/2EEQ-SAH/2EEQ-SAH_decoys.pdbqt | data/2E/2EEQ-SAH/2EEQ-SAH_decoy_scores.csv |
2E9S-GDP | data/2E/2E9S-GDP/2E9S-GDP_ligand.pdbqt | data/2E/2E9S-GDP/2E9S-GDP_target.pdbqt | data/2E/2E9S-GDP/2E9S-GDP_decoys.pdbqt | data/2E/2E9S-GDP/2E9S-GDP_decoy_scores.csv |
2EW5-Y12 | data/2E/2EW5-Y12/2EW5-Y12_ligand.pdbqt | data/2E/2EW5-Y12/2EW5-Y12_target.pdbqt | data/2E/2EW5-Y12/2EW5-Y12_decoys.pdbqt | data/2E/2EW5-Y12/2EW5-Y12_decoy_scores.csv |
2E6Y-U5P | data/2E/2E6Y-U5P/2E6Y-U5P_ligand.pdbqt | data/2E/2E6Y-U5P/2E6Y-U5P_target.pdbqt | data/2E/2E6Y-U5P/2E6Y-U5P_decoys.pdbqt | data/2E/2E6Y-U5P/2E6Y-U5P_decoy_scores.csv |
2E7U-PMP | data/2E/2E7U-PMP/2E7U-PMP_ligand.pdbqt | data/2E/2E7U-PMP/2E7U-PMP_target.pdbqt | data/2E/2E7U-PMP/2E7U-PMP_decoys.pdbqt | data/2E/2E7U-PMP/2E7U-PMP_decoy_scores.csv |
2E2P-ADP | data/2E/2E2P-ADP/2E2P-ADP_ligand.pdbqt | data/2E/2E2P-ADP/2E2P-ADP_target.pdbqt | data/2E/2E2P-ADP/2E2P-ADP_decoys.pdbqt | data/2E/2E2P-ADP/2E2P-ADP_decoy_scores.csv |
2ERV-CXE | data/2E/2ERV-CXE/2ERV-CXE_ligand.pdbqt | data/2E/2ERV-CXE/2ERV-CXE_target.pdbqt | data/2E/2ERV-CXE/2ERV-CXE_decoys.pdbqt | data/2E/2ERV-CXE/2ERV-CXE_decoy_scores.csv |
2EQ7-NAD | data/2E/2EQ7-NAD/2EQ7-NAD_ligand.pdbqt | data/2E/2EQ7-NAD/2EQ7-NAD_target.pdbqt | data/2E/2EQ7-NAD/2EQ7-NAD_decoys.pdbqt | data/2E/2EQ7-NAD/2EQ7-NAD_decoy_scores.csv |
2EI0-BP7 | data/2E/2EI0-BP7/2EI0-BP7_ligand.pdbqt | data/2E/2EI0-BP7/2EI0-BP7_target.pdbqt | data/2E/2EI0-BP7/2EI0-BP7_decoys.pdbqt | data/2E/2EI0-BP7/2EI0-BP7_decoy_scores.csv |
2EI8-DT8 | data/2E/2EI8-DT8/2EI8-DT8_ligand.pdbqt | data/2E/2EI8-DT8/2EI8-DT8_target.pdbqt | data/2E/2EI8-DT8/2EI8-DT8_decoys.pdbqt | data/2E/2EI8-DT8/2EI8-DT8_decoy_scores.csv |
2EVC-FC3 | data/2E/2EVC-FC3/2EVC-FC3_ligand.pdbqt | data/2E/2EVC-FC3/2EVC-FC3_target.pdbqt | data/2E/2EVC-FC3/2EVC-FC3_decoys.pdbqt | data/2E/2EVC-FC3/2EVC-FC3_decoy_scores.csv |
2EJJ-SAH | data/2E/2EJJ-SAH/2EJJ-SAH_ligand.pdbqt | data/2E/2EJJ-SAH/2EJJ-SAH_target.pdbqt | data/2E/2EJJ-SAH/2EJJ-SAH_decoys.pdbqt | data/2E/2EJJ-SAH/2EJJ-SAH_decoy_scores.csv |
2EJ3-GBN | data/2E/2EJ3-GBN/2EJ3-GBN_ligand.pdbqt | data/2E/2EJ3-GBN/2EJ3-GBN_target.pdbqt | data/2E/2EJ3-GBN/2EJ3-GBN_decoys.pdbqt | data/2E/2EJ3-GBN/2EJ3-GBN_decoy_scores.csv |
2EFX-NFA | data/2E/2EFX-NFA/2EFX-NFA_ligand.pdbqt | data/2E/2EFX-NFA/2EFX-NFA_target.pdbqt | null | null |
2ERX-GDP | data/2E/2ERX-GDP/2ERX-GDP_ligand.pdbqt | data/2E/2ERX-GDP/2ERX-GDP_target.pdbqt | data/2E/2ERX-GDP/2ERX-GDP_decoys.pdbqt | data/2E/2ERX-GDP/2ERX-GDP_decoy_scores.csv |
2EK2-SAH | data/2E/2EK2-SAH/2EK2-SAH_ligand.pdbqt | data/2E/2EK2-SAH/2EK2-SAH_target.pdbqt | data/2E/2EK2-SAH/2EK2-SAH_decoys.pdbqt | data/2E/2EK2-SAH/2EK2-SAH_decoy_scores.csv |
2EX6-AIX | data/2E/2EX6-AIX/2EX6-AIX_ligand.pdbqt | data/2E/2EX6-AIX/2EX6-AIX_target.pdbqt | data/2E/2EX6-AIX/2EX6-AIX_decoys.pdbqt | data/2E/2EX6-AIX/2EX6-AIX_decoy_scores.csv |
2EJF-ADN | data/2E/2EJF-ADN/2EJF-ADN_ligand.pdbqt | data/2E/2EJF-ADN/2EJF-ADN_target.pdbqt | data/2E/2EJF-ADN/2EJF-ADN_decoys.pdbqt | data/2E/2EJF-ADN/2EJF-ADN_decoy_scores.csv |
2EA1-GPG | data/2E/2EA1-GPG/2EA1-GPG_ligand.pdbqt | data/2E/2EA1-GPG/2EA1-GPG_target.pdbqt | data/2E/2EA1-GPG/2EA1-GPG_decoys.pdbqt | data/2E/2EA1-GPG/2EA1-GPG_decoy_scores.csv |
2E2O-BGC | data/2E/2E2O-BGC/2E2O-BGC_ligand.pdbqt | data/2E/2E2O-BGC/2E2O-BGC_target.pdbqt | data/2E/2E2O-BGC/2E2O-BGC_decoys.pdbqt | data/2E/2E2O-BGC/2E2O-BGC_decoy_scores.csv |
2E15-SAH | data/2E/2E15-SAH/2E15-SAH_ligand.pdbqt | data/2E/2E15-SAH/2E15-SAH_target.pdbqt | data/2E/2E15-SAH/2E15-SAH_decoys.pdbqt | data/2E/2E15-SAH/2E15-SAH_decoy_scores.csv |
2ECU-1PG | data/2E/2ECU-1PG/2ECU-1PG_ligand.pdbqt | data/2E/2ECU-1PG/2ECU-1PG_target.pdbqt | data/2E/2ECU-1PG/2ECU-1PG_decoys.pdbqt | data/2E/2ECU-1PG/2ECU-1PG_decoy_scores.csv |
2E0N-SAH | data/2E/2E0N-SAH/2E0N-SAH_ligand.pdbqt | data/2E/2E0N-SAH/2E0N-SAH_target.pdbqt | data/2E/2E0N-SAH/2E0N-SAH_decoys.pdbqt | data/2E/2E0N-SAH/2E0N-SAH_decoy_scores.csv |
2EWP-TXF | data/2E/2EWP-TXF/2EWP-TXF_ligand.pdbqt | data/2E/2EWP-TXF/2EWP-TXF_target.pdbqt | data/2E/2EWP-TXF/2EWP-TXF_decoys.pdbqt | data/2E/2EWP-TXF/2EWP-TXF_decoy_scores.csv |
2E08-SAH | data/2E/2E08-SAH/2E08-SAH_ligand.pdbqt | data/2E/2E08-SAH/2E08-SAH_target.pdbqt | data/2E/2E08-SAH/2E08-SAH_decoys.pdbqt | data/2E/2E08-SAH/2E08-SAH_decoy_scores.csv |
2EFJ-SAH | data/2E/2EFJ-SAH/2EFJ-SAH_ligand.pdbqt | data/2E/2EFJ-SAH/2EFJ-SAH_target.pdbqt | data/2E/2EFJ-SAH/2EFJ-SAH_decoys.pdbqt | data/2E/2EFJ-SAH/2EFJ-SAH_decoy_scores.csv |
2EG7-OTD | data/2E/2EG7-OTD/2EG7-OTD_ligand.pdbqt | data/2E/2EG7-OTD/2EG7-OTD_target.pdbqt | data/2E/2EG7-OTD/2EG7-OTD_decoys.pdbqt | data/2E/2EG7-OTD/2EG7-OTD_decoy_scores.csv |
2E8R-SAH | data/2E/2E8R-SAH/2E8R-SAH_ligand.pdbqt | data/2E/2E8R-SAH/2E8R-SAH_target.pdbqt | data/2E/2E8R-SAH/2E8R-SAH_decoys.pdbqt | data/2E/2E8R-SAH/2E8R-SAH_decoy_scores.csv |
2EFU-PHE | data/2E/2EFU-PHE/2EFU-PHE_ligand.pdbqt | data/2E/2EFU-PHE/2EFU-PHE_target.pdbqt | null | null |
2EC9-24X | data/2E/2EC9-24X/2EC9-24X_ligand.pdbqt | data/2E/2EC9-24X/2EC9-24X_target.pdbqt | data/2E/2EC9-24X/2EC9-24X_decoys.pdbqt | data/2E/2EC9-24X/2EC9-24X_decoy_scores.csv |
2EL3-SAH | data/2E/2EL3-SAH/2EL3-SAH_ligand.pdbqt | data/2E/2EL3-SAH/2EL3-SAH_target.pdbqt | data/2E/2EL3-SAH/2EL3-SAH_decoys.pdbqt | data/2E/2EL3-SAH/2EL3-SAH_decoy_scores.csv |
2E4U-GLU | data/2E/2E4U-GLU/2E4U-GLU_ligand.pdbqt | data/2E/2E4U-GLU/2E4U-GLU_target.pdbqt | data/2E/2E4U-GLU/2E4U-GLU_decoys.pdbqt | data/2E/2E4U-GLU/2E4U-GLU_decoy_scores.csv |
2E5W-MTA | data/2E/2E5W-MTA/2E5W-MTA_ligand.pdbqt | data/2E/2E5W-MTA/2E5W-MTA_target.pdbqt | data/2E/2E5W-MTA/2E5W-MTA_decoys.pdbqt | data/2E/2E5W-MTA/2E5W-MTA_decoy_scores.csv |
2EC9-ASO | data/2E/2EC9-ASO/2EC9-ASO_ligand.pdbqt | data/2E/2EC9-ASO/2EC9-ASO_target.pdbqt | data/2E/2EC9-ASO/2EC9-ASO_decoys.pdbqt | data/2E/2EC9-ASO/2EC9-ASO_decoy_scores.csv |
2EFJ-37T | data/2E/2EFJ-37T/2EFJ-37T_ligand.pdbqt | data/2E/2EFJ-37T/2EFJ-37T_target.pdbqt | data/2E/2EFJ-37T/2EFJ-37T_decoys.pdbqt | data/2E/2EFJ-37T/2EFJ-37T_decoy_scores.csv |
2E5Y-ATP | data/2E/2E5Y-ATP/2E5Y-ATP_ligand.pdbqt | data/2E/2E5Y-ATP/2E5Y-ATP_target.pdbqt | data/2E/2E5Y-ATP/2E5Y-ATP_decoys.pdbqt | data/2E/2E5Y-ATP/2E5Y-ATP_decoy_scores.csv |
2EWB-ZED | data/2E/2EWB-ZED/2EWB-ZED_ligand.pdbqt | data/2E/2EWB-ZED/2EWB-ZED_target.pdbqt | data/2E/2EWB-ZED/2EWB-ZED_decoys.pdbqt | data/2E/2EWB-ZED/2EWB-ZED_decoy_scores.csv |
2E3R-18C | data/2E/2E3R-18C/2E3R-18C_ligand.pdbqt | data/2E/2E3R-18C/2E3R-18C_target.pdbqt | data/2E/2E3R-18C/2E3R-18C_decoys.pdbqt | data/2E/2E3R-18C/2E3R-18C_decoy_scores.csv |
2EPN-NGT | data/2E/2EPN-NGT/2EPN-NGT_ligand.pdbqt | data/2E/2EPN-NGT/2EPN-NGT_target.pdbqt | data/2E/2EPN-NGT/2EPN-NGT_decoys.pdbqt | data/2E/2EPN-NGT/2EPN-NGT_decoy_scores.csv |
2E93-B29 | data/2E/2E93-B29/2E93-B29_ligand.pdbqt | data/2E/2E93-B29/2E93-B29_target.pdbqt | data/2E/2E93-B29/2E93-B29_decoys.pdbqt | data/2E/2E93-B29/2E93-B29_decoy_scores.csv |
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