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 ⌀ |
|---|---|---|---|---|
7XW8-I00 | data/7X/7XW8-I00/7XW8-I00_ligand.pdbqt | data/7X/7XW8-I00/7XW8-I00_target.pdbqt | data/7X/7XW8-I00/7XW8-I00_decoys.pdbqt | data/7X/7XW8-I00/7XW8-I00_decoy_scores.csv |
7XMA-CHD | data/7X/7XMA-CHD/7XMA-CHD_ligand.pdbqt | data/7X/7XMA-CHD/7XMA-CHD_target.pdbqt | data/7X/7XMA-CHD/7XMA-CHD_decoys.pdbqt | data/7X/7XMA-CHD/7XMA-CHD_decoy_scores.csv |
7XKF-AND | data/7X/7XKF-AND/7XKF-AND_ligand.pdbqt | data/7X/7XKF-AND/7XKF-AND_target.pdbqt | data/7X/7XKF-AND/7XKF-AND_decoys.pdbqt | data/7X/7XKF-AND/7XKF-AND_decoy_scores.csv |
7XZT-I9P | data/7X/7XZT-I9P/7XZT-I9P_ligand.pdbqt | data/7X/7XZT-I9P/7XZT-I9P_target.pdbqt | data/7X/7XZT-I9P/7XZT-I9P_decoys.pdbqt | data/7X/7XZT-I9P/7XZT-I9P_decoy_scores.csv |
7X4U-BTB | data/7X/7X4U-BTB/7X4U-BTB_ligand.pdbqt | data/7X/7X4U-BTB/7X4U-BTB_target.pdbqt | data/7X/7X4U-BTB/7X4U-BTB_decoys.pdbqt | data/7X/7X4U-BTB/7X4U-BTB_decoy_scores.csv |
7XRA-FPP | data/7X/7XRA-FPP/7XRA-FPP_ligand.pdbqt | data/7X/7XRA-FPP/7XRA-FPP_target.pdbqt | data/7X/7XRA-FPP/7XRA-FPP_decoys.pdbqt | data/7X/7XRA-FPP/7XRA-FPP_decoy_scores.csv |
7X8D-PPY | data/7X/7X8D-PPY/7X8D-PPY_ligand.pdbqt | data/7X/7X8D-PPY/7X8D-PPY_target.pdbqt | data/7X/7X8D-PPY/7X8D-PPY_decoys.pdbqt | data/7X/7X8D-PPY/7X8D-PPY_decoy_scores.csv |
7XLP-FZC | data/7X/7XLP-FZC/7XLP-FZC_ligand.pdbqt | data/7X/7XLP-FZC/7XLP-FZC_target.pdbqt | data/7X/7XLP-FZC/7XLP-FZC_decoys.pdbqt | data/7X/7XLP-FZC/7XLP-FZC_decoy_scores.csv |
7XH6-JHL | data/7X/7XH6-JHL/7XH6-JHL_ligand.pdbqt | data/7X/7XH6-JHL/7XH6-JHL_target.pdbqt | data/7X/7XH6-JHL/7XH6-JHL_decoys.pdbqt | data/7X/7XH6-JHL/7XH6-JHL_decoy_scores.csv |
7X4U-8DK | data/7X/7X4U-8DK/7X4U-8DK_ligand.pdbqt | data/7X/7X4U-8DK/7X4U-8DK_target.pdbqt | data/7X/7X4U-8DK/7X4U-8DK_decoys.pdbqt | data/7X/7X4U-8DK/7X4U-8DK_decoy_scores.csv |
7X5U-9R6 | data/7X/7X5U-9R6/7X5U-9R6_ligand.pdbqt | data/7X/7X5U-9R6/7X5U-9R6_target.pdbqt | data/7X/7X5U-9R6/7X5U-9R6_decoys.pdbqt | data/7X/7X5U-9R6/7X5U-9R6_decoy_scores.csv |
7X62-9XI | data/7X/7X62-9XI/7X62-9XI_ligand.pdbqt | data/7X/7X62-9XI/7X62-9XI_target.pdbqt | data/7X/7X62-9XI/7X62-9XI_decoys.pdbqt | data/7X/7X62-9XI/7X62-9XI_decoy_scores.csv |
7X32-BER | data/7X/7X32-BER/7X32-BER_ligand.pdbqt | data/7X/7X32-BER/7X32-BER_target.pdbqt | data/7X/7X32-BER/7X32-BER_decoys.pdbqt | data/7X/7X32-BER/7X32-BER_decoy_scores.csv |
7XXF-I7D | data/7X/7XXF-I7D/7XXF-I7D_ligand.pdbqt | data/7X/7XXF-I7D/7XXF-I7D_target.pdbqt | data/7X/7XXF-I7D/7XXF-I7D_decoys.pdbqt | data/7X/7XXF-I7D/7XXF-I7D_decoy_scores.csv |
7XC1-B8Z | data/7X/7XC1-B8Z/7XC1-B8Z_ligand.pdbqt | data/7X/7XC1-B8Z/7XC1-B8Z_target.pdbqt | data/7X/7XC1-B8Z/7XC1-B8Z_decoys.pdbqt | data/7X/7XC1-B8Z/7XC1-B8Z_decoy_scores.csv |
7XJ5-ECW | data/7X/7XJ5-ECW/7XJ5-ECW_ligand.pdbqt | data/7X/7XJ5-ECW/7XJ5-ECW_target.pdbqt | data/7X/7XJ5-ECW/7XJ5-ECW_decoys.pdbqt | data/7X/7XJ5-ECW/7XJ5-ECW_decoy_scores.csv |
7XAR-BOV | data/7X/7XAR-BOV/7XAR-BOV_ligand.pdbqt | data/7X/7XAR-BOV/7XAR-BOV_target.pdbqt | data/7X/7XAR-BOV/7XAR-BOV_decoys.pdbqt | data/7X/7XAR-BOV/7XAR-BOV_decoy_scores.csv |
7XQF-Y01 | data/7X/7XQF-Y01/7XQF-Y01_ligand.pdbqt | data/7X/7XQF-Y01/7XQF-Y01_target.pdbqt | data/7X/7XQF-Y01/7XQF-Y01_decoys.pdbqt | data/7X/7XQF-Y01/7XQF-Y01_decoy_scores.csv |
7XJD-L2P | data/7X/7XJD-L2P/7XJD-L2P_ligand.pdbqt | data/7X/7XJD-L2P/7XJD-L2P_target.pdbqt | data/7X/7XJD-L2P/7XJD-L2P_decoys.pdbqt | data/7X/7XJD-L2P/7XJD-L2P_decoy_scores.csv |
7XAA-AQL | data/7X/7XAA-AQL/7XAA-AQL_ligand.pdbqt | data/7X/7XAA-AQL/7XAA-AQL_target.pdbqt | data/7X/7XAA-AQL/7XAA-AQL_decoys.pdbqt | data/7X/7XAA-AQL/7XAA-AQL_decoy_scores.csv |
7XH4-EN7 | data/7X/7XH4-EN7/7XH4-EN7_ligand.pdbqt | data/7X/7XH4-EN7/7XH4-EN7_target.pdbqt | data/7X/7XH4-EN7/7XH4-EN7_decoys.pdbqt | data/7X/7XH4-EN7/7XH4-EN7_decoy_scores.csv |
7XZR-ANP | data/7X/7XZR-ANP/7XZR-ANP_ligand.pdbqt | data/7X/7XZR-ANP/7XZR-ANP_target.pdbqt | data/7X/7XZR-ANP/7XZR-ANP_decoys.pdbqt | data/7X/7XZR-ANP/7XZR-ANP_decoy_scores.csv |
7XE2-FLC | data/7X/7XE2-FLC/7XE2-FLC_ligand.pdbqt | data/7X/7XE2-FLC/7XE2-FLC_target.pdbqt | data/7X/7XE2-FLC/7XE2-FLC_decoys.pdbqt | data/7X/7XE2-FLC/7XE2-FLC_decoy_scores.csv |
7XE1-FLC | data/7X/7XE1-FLC/7XE1-FLC_ligand.pdbqt | data/7X/7XE1-FLC/7XE1-FLC_target.pdbqt | data/7X/7XE1-FLC/7XE1-FLC_decoys.pdbqt | data/7X/7XE1-FLC/7XE1-FLC_decoy_scores.csv |
7XXK-GUN | data/7X/7XXK-GUN/7XXK-GUN_ligand.pdbqt | data/7X/7XXK-GUN/7XXK-GUN_target.pdbqt | data/7X/7XXK-GUN/7XXK-GUN_decoys.pdbqt | data/7X/7XXK-GUN/7XXK-GUN_decoy_scores.csv |
7X7J-LYS | data/7X/7X7J-LYS/7X7J-LYS_ligand.pdbqt | data/7X/7X7J-LYS/7X7J-LYS_target.pdbqt | data/7X/7X7J-LYS/7X7J-LYS_decoys.pdbqt | data/7X/7X7J-LYS/7X7J-LYS_decoy_scores.csv |
7X4P-UTP | data/7X/7X4P-UTP/7X4P-UTP_ligand.pdbqt | data/7X/7X4P-UTP/7X4P-UTP_target.pdbqt | data/7X/7X4P-UTP/7X4P-UTP_decoys.pdbqt | data/7X/7X4P-UTP/7X4P-UTP_decoy_scores.csv |
7X6F-FLC | data/7X/7X6F-FLC/7X6F-FLC_ligand.pdbqt | data/7X/7X6F-FLC/7X6F-FLC_target.pdbqt | data/7X/7X6F-FLC/7X6F-FLC_decoys.pdbqt | data/7X/7X6F-FLC/7X6F-FLC_decoy_scores.csv |
7X68-BX0 | data/7X/7X68-BX0/7X68-BX0_ligand.pdbqt | data/7X/7X68-BX0/7X68-BX0_target.pdbqt | data/7X/7X68-BX0/7X68-BX0_decoys.pdbqt | data/7X/7X68-BX0/7X68-BX0_decoy_scores.csv |
7X5N-5M5 | data/7X/7X5N-5M5/7X5N-5M5_ligand.pdbqt | data/7X/7X5N-5M5/7X5N-5M5_target.pdbqt | data/7X/7X5N-5M5/7X5N-5M5_decoys.pdbqt | data/7X/7X5N-5M5/7X5N-5M5_decoy_scores.csv |
7XWR-I2B | data/7X/7XWR-I2B/7XWR-I2B_ligand.pdbqt | data/7X/7XWR-I2B/7XWR-I2B_target.pdbqt | data/7X/7XWR-I2B/7XWR-I2B_decoys.pdbqt | data/7X/7XWR-I2B/7XWR-I2B_decoy_scores.csv |
7X4U-5ID | data/7X/7X4U-5ID/7X4U-5ID_ligand.pdbqt | data/7X/7X4U-5ID/7X4U-5ID_target.pdbqt | data/7X/7X4U-5ID/7X4U-5ID_decoys.pdbqt | data/7X/7X4U-5ID/7X4U-5ID_decoy_scores.csv |
7X7K-ARG | data/7X/7X7K-ARG/7X7K-ARG_ligand.pdbqt | data/7X/7X7K-ARG/7X7K-ARG_target.pdbqt | data/7X/7X7K-ARG/7X7K-ARG_decoys.pdbqt | data/7X/7X7K-ARG/7X7K-ARG_decoy_scores.csv |
7XIT-E6I | data/7X/7XIT-E6I/7XIT-E6I_ligand.pdbqt | data/7X/7XIT-E6I/7XIT-E6I_target.pdbqt | data/7X/7XIT-E6I/7XIT-E6I_decoys.pdbqt | data/7X/7XIT-E6I/7XIT-E6I_decoy_scores.csv |
7X81-9LC | data/7X/7X81-9LC/7X81-9LC_ligand.pdbqt | data/7X/7X81-9LC/7X81-9LC_target.pdbqt | data/7X/7X81-9LC/7X81-9LC_decoys.pdbqt | data/7X/7X81-9LC/7X81-9LC_decoy_scores.csv |
7XM7-GAY | data/7X/7XM7-GAY/7XM7-GAY_ligand.pdbqt | data/7X/7XM7-GAY/7XM7-GAY_target.pdbqt | data/7X/7XM7-GAY/7XM7-GAY_decoys.pdbqt | data/7X/7XM7-GAY/7XM7-GAY_decoy_scores.csv |
7XTO-1DA | data/7X/7XTO-1DA/7XTO-1DA_ligand.pdbqt | data/7X/7XTO-1DA/7XTO-1DA_target.pdbqt | data/7X/7XTO-1DA/7XTO-1DA_decoys.pdbqt | data/7X/7XTO-1DA/7XTO-1DA_decoy_scores.csv |
7XIF-TER | data/7X/7XIF-TER/7XIF-TER_ligand.pdbqt | data/7X/7XIF-TER/7XIF-TER_target.pdbqt | data/7X/7XIF-TER/7XIF-TER_decoys.pdbqt | data/7X/7XIF-TER/7XIF-TER_decoy_scores.csv |
7XF8-NDG | data/7X/7XF8-NDG/7XF8-NDG_ligand.pdbqt | data/7X/7XF8-NDG/7XF8-NDG_target.pdbqt | data/7X/7XF8-NDG/7XF8-NDG_decoys.pdbqt | data/7X/7XF8-NDG/7XF8-NDG_decoy_scores.csv |
7XXK-GMP | data/7X/7XXK-GMP/7XXK-GMP_ligand.pdbqt | data/7X/7XXK-GMP/7XXK-GMP_target.pdbqt | data/7X/7XXK-GMP/7XXK-GMP_decoys.pdbqt | data/7X/7XXK-GMP/7XXK-GMP_decoy_scores.csv |
7XHQ-FIZ | data/7X/7XHQ-FIZ/7XHQ-FIZ_ligand.pdbqt | data/7X/7XHQ-FIZ/7XHQ-FIZ_target.pdbqt | data/7X/7XHQ-FIZ/7XHQ-FIZ_decoys.pdbqt | data/7X/7XHQ-FIZ/7XHQ-FIZ_decoy_scores.csv |
7XYI-NHE | data/7X/7XYI-NHE/7XYI-NHE_ligand.pdbqt | data/7X/7XYI-NHE/7XYI-NHE_target.pdbqt | data/7X/7XYI-NHE/7XYI-NHE_decoys.pdbqt | data/7X/7XYI-NHE/7XYI-NHE_decoy_scores.csv |
7X5Y-HZS | data/7X/7X5Y-HZS/7X5Y-HZS_ligand.pdbqt | data/7X/7X5Y-HZS/7X5Y-HZS_target.pdbqt | data/7X/7X5Y-HZS/7X5Y-HZS_decoys.pdbqt | data/7X/7X5Y-HZS/7X5Y-HZS_decoy_scores.csv |
7XVZ-I1D | data/7X/7XVZ-I1D/7XVZ-I1D_ligand.pdbqt | data/7X/7XVZ-I1D/7XVZ-I1D_target.pdbqt | data/7X/7XVZ-I1D/7XVZ-I1D_decoys.pdbqt | data/7X/7XVZ-I1D/7XVZ-I1D_decoy_scores.csv |
7XI0-EL0 | data/7X/7XI0-EL0/7XI0-EL0_ligand.pdbqt | data/7X/7XI0-EL0/7XI0-EL0_target.pdbqt | data/7X/7XI0-EL0/7XI0-EL0_decoys.pdbqt | data/7X/7XI0-EL0/7XI0-EL0_decoy_scores.csv |
7X2Y-NAD | data/7X/7X2Y-NAD/7X2Y-NAD_ligand.pdbqt | data/7X/7X2Y-NAD/7X2Y-NAD_target.pdbqt | data/7X/7X2Y-NAD/7X2Y-NAD_decoys.pdbqt | data/7X/7X2Y-NAD/7X2Y-NAD_decoy_scores.csv |
7XWN-I8L | data/7X/7XWN-I8L/7XWN-I8L_ligand.pdbqt | data/7X/7XWN-I8L/7XWN-I8L_target.pdbqt | data/7X/7XWN-I8L/7XWN-I8L_decoys.pdbqt | data/7X/7XWN-I8L/7XWN-I8L_decoy_scores.csv |
7X8I-FNO | data/7X/7X8I-FNO/7X8I-FNO_ligand.pdbqt | data/7X/7X8I-FNO/7X8I-FNO_target.pdbqt | data/7X/7X8I-FNO/7X8I-FNO_decoys.pdbqt | data/7X/7X8I-FNO/7X8I-FNO_decoy_scores.csv |
7X6M-9ZU | data/7X/7X6M-9ZU/7X6M-9ZU_ligand.pdbqt | data/7X/7X6M-9ZU/7X6M-9ZU_target.pdbqt | data/7X/7X6M-9ZU/7X6M-9ZU_decoys.pdbqt | data/7X/7X6M-9ZU/7X6M-9ZU_decoy_scores.csv |
7XGL-0L1 | data/7X/7XGL-0L1/7XGL-0L1_ligand.pdbqt | data/7X/7XGL-0L1/7XGL-0L1_target.pdbqt | data/7X/7XGL-0L1/7XGL-0L1_decoys.pdbqt | data/7X/7XGL-0L1/7XGL-0L1_decoy_scores.csv |
7XE2-DIJ | data/7X/7XE2-DIJ/7XE2-DIJ_ligand.pdbqt | data/7X/7XE2-DIJ/7XE2-DIJ_target.pdbqt | data/7X/7XE2-DIJ/7XE2-DIJ_decoys.pdbqt | data/7X/7XE2-DIJ/7XE2-DIJ_decoy_scores.csv |
7XNC-GIK | data/7X/7XNC-GIK/7XNC-GIK_ligand.pdbqt | data/7X/7XNC-GIK/7XNC-GIK_target.pdbqt | data/7X/7XNC-GIK/7XNC-GIK_decoys.pdbqt | data/7X/7XNC-GIK/7XNC-GIK_decoy_scores.csv |
7XEY-RP5 | data/7X/7XEY-RP5/7XEY-RP5_ligand.pdbqt | data/7X/7XEY-RP5/7XEY-RP5_target.pdbqt | data/7X/7XEY-RP5/7XEY-RP5_decoys.pdbqt | data/7X/7XEY-RP5/7XEY-RP5_decoy_scores.csv |
7XWV-V55 | data/7X/7XWV-V55/7XWV-V55_ligand.pdbqt | data/7X/7XWV-V55/7XWV-V55_target.pdbqt | data/7X/7XWV-V55/7XWV-V55_decoys.pdbqt | data/7X/7XWV-V55/7XWV-V55_decoy_scores.csv |
7X11-86I | data/7X/7X11-86I/7X11-86I_ligand.pdbqt | data/7X/7X11-86I/7X11-86I_target.pdbqt | data/7X/7X11-86I/7X11-86I_decoys.pdbqt | data/7X/7X11-86I/7X11-86I_decoy_scores.csv |
7X5R-9P5 | data/7X/7X5R-9P5/7X5R-9P5_ligand.pdbqt | data/7X/7X5R-9P5/7X5R-9P5_target.pdbqt | data/7X/7X5R-9P5/7X5R-9P5_decoys.pdbqt | data/7X/7X5R-9P5/7X5R-9P5_decoy_scores.csv |
7XBN-PXI | data/7X/7XBN-PXI/7XBN-PXI_ligand.pdbqt | data/7X/7XBN-PXI/7XBN-PXI_target.pdbqt | data/7X/7XBN-PXI/7XBN-PXI_decoys.pdbqt | data/7X/7XBN-PXI/7XBN-PXI_decoy_scores.csv |
7X32-FMN | data/7X/7X32-FMN/7X32-FMN_ligand.pdbqt | data/7X/7X32-FMN/7X32-FMN_target.pdbqt | data/7X/7X32-FMN/7X32-FMN_decoys.pdbqt | data/7X/7X32-FMN/7X32-FMN_decoy_scores.csv |
7X5N-PLS | data/7X/7X5N-PLS/7X5N-PLS_ligand.pdbqt | data/7X/7X5N-PLS/7X5N-PLS_target.pdbqt | data/7X/7X5N-PLS/7X5N-PLS_decoys.pdbqt | data/7X/7X5N-PLS/7X5N-PLS_decoy_scores.csv |
7XJC-L2P | data/7X/7XJC-L2P/7XJC-L2P_ligand.pdbqt | data/7X/7XJC-L2P/7XJC-L2P_target.pdbqt | data/7X/7XJC-L2P/7XJC-L2P_decoys.pdbqt | data/7X/7XJC-L2P/7XJC-L2P_decoy_scores.csv |
7X3Z-NAD | data/7X/7X3Z-NAD/7X3Z-NAD_ligand.pdbqt | data/7X/7X3Z-NAD/7X3Z-NAD_target.pdbqt | data/7X/7X3Z-NAD/7X3Z-NAD_decoys.pdbqt | data/7X/7X3Z-NAD/7X3Z-NAD_decoy_scores.csv |
7XNE-GHF | data/7X/7XNE-GHF/7XNE-GHF_ligand.pdbqt | data/7X/7XNE-GHF/7XNE-GHF_target.pdbqt | data/7X/7XNE-GHF/7XNE-GHF_decoys.pdbqt | data/7X/7XNE-GHF/7XNE-GHF_decoy_scores.csv |
7XER-CLR | data/7X/7XER-CLR/7XER-CLR_ligand.pdbqt | data/7X/7XER-CLR/7XER-CLR_target.pdbqt | data/7X/7XER-CLR/7XER-CLR_decoys.pdbqt | data/7X/7XER-CLR/7XER-CLR_decoy_scores.csv |
7X8P-PAM | data/7X/7X8P-PAM/7X8P-PAM_ligand.pdbqt | data/7X/7X8P-PAM/7X8P-PAM_target.pdbqt | data/7X/7X8P-PAM/7X8P-PAM_decoys.pdbqt | data/7X/7X8P-PAM/7X8P-PAM_decoy_scores.csv |
7XNG-GI5 | data/7X/7XNG-GI5/7XNG-GI5_ligand.pdbqt | data/7X/7XNG-GI5/7XNG-GI5_target.pdbqt | data/7X/7XNG-GI5/7XNG-GI5_decoys.pdbqt | data/7X/7XNG-GI5/7XNG-GI5_decoy_scores.csv |
7X5Z-9WC | data/7X/7X5Z-9WC/7X5Z-9WC_ligand.pdbqt | data/7X/7X5Z-9WC/7X5Z-9WC_target.pdbqt | data/7X/7X5Z-9WC/7X5Z-9WC_decoys.pdbqt | data/7X/7X5Z-9WC/7X5Z-9WC_decoy_scores.csv |
7XJE-L2P | data/7X/7XJE-L2P/7XJE-L2P_ligand.pdbqt | data/7X/7XJE-L2P/7XJE-L2P_target.pdbqt | data/7X/7XJE-L2P/7XJE-L2P_decoys.pdbqt | data/7X/7XJE-L2P/7XJE-L2P_decoy_scores.csv |
7XHY-E0X | data/7X/7XHY-E0X/7XHY-E0X_ligand.pdbqt | data/7X/7XHY-E0X/7XHY-E0X_target.pdbqt | data/7X/7XHY-E0X/7XHY-E0X_decoys.pdbqt | data/7X/7XHY-E0X/7XHY-E0X_decoy_scores.csv |
7X0B-SAM | data/7X/7X0B-SAM/7X0B-SAM_ligand.pdbqt | data/7X/7X0B-SAM/7X0B-SAM_target.pdbqt | data/7X/7X0B-SAM/7X0B-SAM_decoys.pdbqt | data/7X/7X0B-SAM/7X0B-SAM_decoy_scores.csv |
7X5J-PHE | data/7X/7X5J-PHE/7X5J-PHE_ligand.pdbqt | data/7X/7X5J-PHE/7X5J-PHE_target.pdbqt | data/7X/7X5J-PHE/7X5J-PHE_decoys.pdbqt | data/7X/7X5J-PHE/7X5J-PHE_decoy_scores.csv |
7X4H-8BH | data/7X/7X4H-8BH/7X4H-8BH_ligand.pdbqt | data/7X/7X4H-8BH/7X4H-8BH_target.pdbqt | data/7X/7X4H-8BH/7X4H-8BH_decoys.pdbqt | data/7X/7X4H-8BH/7X4H-8BH_decoy_scores.csv |
7X50-87K | data/7X/7X50-87K/7X50-87K_ligand.pdbqt | data/7X/7X50-87K/7X50-87K_target.pdbqt | data/7X/7X50-87K/7X50-87K_decoys.pdbqt | data/7X/7X50-87K/7X50-87K_decoy_scores.csv |
7X3O-8IT | data/7X/7X3O-8IT/7X3O-8IT_ligand.pdbqt | data/7X/7X3O-8IT/7X3O-8IT_target.pdbqt | data/7X/7X3O-8IT/7X3O-8IT_decoys.pdbqt | data/7X/7X3O-8IT/7X3O-8IT_decoy_scores.csv |
7X5R-BCN | data/7X/7X5R-BCN/7X5R-BCN_ligand.pdbqt | data/7X/7X5R-BCN/7X5R-BCN_target.pdbqt | data/7X/7X5R-BCN/7X5R-BCN_decoys.pdbqt | data/7X/7X5R-BCN/7X5R-BCN_decoy_scores.csv |
7X5B-ADP | data/7X/7X5B-ADP/7X5B-ADP_ligand.pdbqt | data/7X/7X5B-ADP/7X5B-ADP_target.pdbqt | data/7X/7X5B-ADP/7X5B-ADP_decoys.pdbqt | data/7X/7X5B-ADP/7X5B-ADP_decoy_scores.csv |
7XI7-4RI | data/7X/7XI7-4RI/7XI7-4RI_ligand.pdbqt | data/7X/7XI7-4RI/7XI7-4RI_target.pdbqt | data/7X/7XI7-4RI/7XI7-4RI_decoys.pdbqt | data/7X/7XI7-4RI/7XI7-4RI_decoy_scores.csv |
7XF7-NDG | data/7X/7XF7-NDG/7XF7-NDG_ligand.pdbqt | data/7X/7XF7-NDG/7XF7-NDG_target.pdbqt | data/7X/7XF7-NDG/7XF7-NDG_decoys.pdbqt | data/7X/7XF7-NDG/7XF7-NDG_decoy_scores.csv |
7XMB-J6X | data/7X/7XMB-J6X/7XMB-J6X_ligand.pdbqt | data/7X/7XMB-J6X/7XMB-J6X_target.pdbqt | data/7X/7XMB-J6X/7XMB-J6X_decoys.pdbqt | data/7X/7XMB-J6X/7XMB-J6X_decoy_scores.csv |
7XQZ-FPF | data/7X/7XQZ-FPF/7XQZ-FPF_ligand.pdbqt | data/7X/7XQZ-FPF/7XQZ-FPF_target.pdbqt | data/7X/7XQZ-FPF/7XQZ-FPF_decoys.pdbqt | data/7X/7XQZ-FPF/7XQZ-FPF_decoy_scores.csv |
7XKT-MC3 | data/7X/7XKT-MC3/7XKT-MC3_ligand.pdbqt | data/7X/7XKT-MC3/7XKT-MC3_target.pdbqt | data/7X/7XKT-MC3/7XKT-MC3_decoys.pdbqt | data/7X/7XKT-MC3/7XKT-MC3_decoy_scores.csv |
7XC4-BJ6 | data/7X/7XC4-BJ6/7XC4-BJ6_ligand.pdbqt | data/7X/7XC4-BJ6/7XC4-BJ6_target.pdbqt | data/7X/7XC4-BJ6/7XC4-BJ6_decoys.pdbqt | data/7X/7XC4-BJ6/7XC4-BJ6_decoy_scores.csv |
7XHE-JHF | data/7X/7XHE-JHF/7XHE-JHF_ligand.pdbqt | data/7X/7XHE-JHF/7XHE-JHF_target.pdbqt | data/7X/7XHE-JHF/7XHE-JHF_decoys.pdbqt | data/7X/7XHE-JHF/7XHE-JHF_decoy_scores.csv |
7XBV-APC | data/7X/7XBV-APC/7XBV-APC_ligand.pdbqt | data/7X/7XBV-APC/7XBV-APC_target.pdbqt | data/7X/7XBV-APC/7XBV-APC_decoys.pdbqt | data/7X/7XBV-APC/7XBV-APC_decoy_scores.csv |
7XZS-I8T | data/7X/7XZS-I8T/7XZS-I8T_ligand.pdbqt | data/7X/7XZS-I8T/7XZS-I8T_target.pdbqt | data/7X/7XZS-I8T/7XZS-I8T_decoys.pdbqt | data/7X/7XZS-I8T/7XZS-I8T_decoy_scores.csv |
7XIJ-EJ3 | data/7X/7XIJ-EJ3/7XIJ-EJ3_ligand.pdbqt | data/7X/7XIJ-EJ3/7XIJ-EJ3_target.pdbqt | data/7X/7XIJ-EJ3/7XIJ-EJ3_decoys.pdbqt | data/7X/7XIJ-EJ3/7XIJ-EJ3_decoy_scores.csv |
7XXN-7Y3 | data/7X/7XXN-7Y3/7XXN-7Y3_ligand.pdbqt | data/7X/7XXN-7Y3/7XXN-7Y3_target.pdbqt | data/7X/7XXN-7Y3/7XXN-7Y3_decoys.pdbqt | data/7X/7XXN-7Y3/7XXN-7Y3_decoy_scores.csv |
7XBT-AMP | data/7X/7XBT-AMP/7XBT-AMP_ligand.pdbqt | data/7X/7XBT-AMP/7XBT-AMP_target.pdbqt | data/7X/7XBT-AMP/7XBT-AMP_decoys.pdbqt | data/7X/7XBT-AMP/7XBT-AMP_decoy_scores.csv |
7XMB-CHD | data/7X/7XMB-CHD/7XMB-CHD_ligand.pdbqt | data/7X/7XMB-CHD/7XMB-CHD_target.pdbqt | data/7X/7XMB-CHD/7XMB-CHD_decoys.pdbqt | data/7X/7XMB-CHD/7XMB-CHD_decoy_scores.csv |
7XC1-5ID | data/7X/7XC1-5ID/7XC1-5ID_ligand.pdbqt | data/7X/7XC1-5ID/7XC1-5ID_target.pdbqt | data/7X/7XC1-5ID/7XC1-5ID_decoys.pdbqt | data/7X/7XC1-5ID/7XC1-5ID_decoy_scores.csv |
7XEE-CXI | data/7X/7XEE-CXI/7XEE-CXI_ligand.pdbqt | data/7X/7XEE-CXI/7XEE-CXI_target.pdbqt | data/7X/7XEE-CXI/7XEE-CXI_decoys.pdbqt | data/7X/7XEE-CXI/7XEE-CXI_decoy_scores.csv |
7X3N-P15 | data/7X/7X3N-P15/7X3N-P15_ligand.pdbqt | data/7X/7X3N-P15/7X3N-P15_target.pdbqt | data/7X/7X3N-P15/7X3N-P15_decoys.pdbqt | data/7X/7X3N-P15/7X3N-P15_decoy_scores.csv |
7X73-J26 | data/7X/7X73-J26/7X73-J26_ligand.pdbqt | data/7X/7X73-J26/7X73-J26_target.pdbqt | data/7X/7X73-J26/7X73-J26_decoys.pdbqt | data/7X/7X73-J26/7X73-J26_decoy_scores.csv |
7X5S-9QL | data/7X/7X5S-9QL/7X5S-9QL_ligand.pdbqt | data/7X/7X5S-9QL/7X5S-9QL_target.pdbqt | data/7X/7X5S-9QL/7X5S-9QL_decoys.pdbqt | data/7X/7X5S-9QL/7X5S-9QL_decoy_scores.csv |
7XKT-Y01 | data/7X/7XKT-Y01/7XKT-Y01_ligand.pdbqt | data/7X/7XKT-Y01/7XKT-Y01_target.pdbqt | data/7X/7XKT-Y01/7XKT-Y01_decoys.pdbqt | data/7X/7XKT-Y01/7XKT-Y01_decoy_scores.csv |
7XE1-DIJ | data/7X/7XE1-DIJ/7XE1-DIJ_ligand.pdbqt | data/7X/7XE1-DIJ/7XE1-DIJ_target.pdbqt | data/7X/7XE1-DIJ/7XE1-DIJ_decoys.pdbqt | data/7X/7XE1-DIJ/7XE1-DIJ_decoy_scores.csv |
7XY5-NHE | data/7X/7XY5-NHE/7XY5-NHE_ligand.pdbqt | data/7X/7XY5-NHE/7XY5-NHE_target.pdbqt | data/7X/7XY5-NHE/7XY5-NHE_decoys.pdbqt | data/7X/7XY5-NHE/7XY5-NHE_decoy_scores.csv |
7X0E-7Z8 | data/7X/7X0E-7Z8/7X0E-7Z8_ligand.pdbqt | data/7X/7X0E-7Z8/7X0E-7Z8_target.pdbqt | data/7X/7X0E-7Z8/7X0E-7Z8_decoys.pdbqt | data/7X/7X0E-7Z8/7X0E-7Z8_decoy_scores.csv |
7XBU-MYN | data/7X/7XBU-MYN/7XBU-MYN_ligand.pdbqt | data/7X/7XBU-MYN/7XBU-MYN_target.pdbqt | data/7X/7XBU-MYN/7XBU-MYN_decoys.pdbqt | data/7X/7XBU-MYN/7XBU-MYN_decoy_scores.csv |
7X4J-DCR | data/7X/7X4J-DCR/7X4J-DCR_ligand.pdbqt | data/7X/7X4J-DCR/7X4J-DCR_target.pdbqt | data/7X/7X4J-DCR/7X4J-DCR_decoys.pdbqt | data/7X/7X4J-DCR/7X4J-DCR_decoy_scores.csv |
7XII-MTA | data/7X/7XII-MTA/7XII-MTA_ligand.pdbqt | data/7X/7XII-MTA/7XII-MTA_target.pdbqt | data/7X/7XII-MTA/7XII-MTA_decoys.pdbqt | data/7X/7XII-MTA/7XII-MTA_decoy_scores.csv |
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