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 ⌀ |
|---|---|---|---|---|
2VJC-CCD | data/2V/2VJC-CCD/2VJC-CCD_ligand.pdbqt | data/2V/2VJC-CCD/2VJC-CCD_target.pdbqt | data/2V/2VJC-CCD/2VJC-CCD_decoys.pdbqt | data/2V/2VJC-CCD/2VJC-CCD_decoy_scores.csv |
2VCW-ZZA | data/2V/2VCW-ZZA/2VCW-ZZA_ligand.pdbqt | data/2V/2VCW-ZZA/2VCW-ZZA_target.pdbqt | data/2V/2VCW-ZZA/2VCW-ZZA_decoys.pdbqt | data/2V/2VCW-ZZA/2VCW-ZZA_decoy_scores.csv |
2VFU-MTL | data/2V/2VFU-MTL/2VFU-MTL_ligand.pdbqt | data/2V/2VFU-MTL/2VFU-MTL_target.pdbqt | data/2V/2VFU-MTL/2VFU-MTL_decoys.pdbqt | data/2V/2VFU-MTL/2VFU-MTL_decoy_scores.csv |
2VU1-OPI | data/2V/2VU1-OPI/2VU1-OPI_ligand.pdbqt | data/2V/2VU1-OPI/2VU1-OPI_target.pdbqt | data/2V/2VU1-OPI/2VU1-OPI_decoys.pdbqt | data/2V/2VU1-OPI/2VU1-OPI_decoy_scores.csv |
2VB6-ADP | data/2V/2VB6-ADP/2VB6-ADP_ligand.pdbqt | data/2V/2VB6-ADP/2VB6-ADP_target.pdbqt | null | null |
2VIP-L1R | data/2V/2VIP-L1R/2VIP-L1R_ligand.pdbqt | data/2V/2VIP-L1R/2VIP-L1R_target.pdbqt | data/2V/2VIP-L1R/2VIP-L1R_decoys.pdbqt | data/2V/2VIP-L1R/2VIP-L1R_decoy_scores.csv |
2V9X-DUT | data/2V/2V9X-DUT/2V9X-DUT_ligand.pdbqt | data/2V/2V9X-DUT/2V9X-DUT_target.pdbqt | data/2V/2V9X-DUT/2V9X-DUT_decoys.pdbqt | data/2V/2V9X-DUT/2V9X-DUT_decoy_scores.csv |
2VZM-NRB | data/2V/2VZM-NRB/2VZM-NRB_ligand.pdbqt | data/2V/2VZM-NRB/2VZM-NRB_target.pdbqt | data/2V/2VZM-NRB/2VZM-NRB_decoys.pdbqt | data/2V/2VZM-NRB/2VZM-NRB_decoy_scores.csv |
2VIV-VG2 | data/2V/2VIV-VG2/2VIV-VG2_ligand.pdbqt | data/2V/2VIV-VG2/2VIV-VG2_target.pdbqt | data/2V/2VIV-VG2/2VIV-VG2_decoys.pdbqt | data/2V/2VIV-VG2/2VIV-VG2_decoy_scores.csv |
2VCN-ISZ | data/2V/2VCN-ISZ/2VCN-ISZ_ligand.pdbqt | data/2V/2VCN-ISZ/2VCN-ISZ_target.pdbqt | data/2V/2VCN-ISZ/2VCN-ISZ_decoys.pdbqt | data/2V/2VCN-ISZ/2VCN-ISZ_decoy_scores.csv |
2V4L-ABJ | data/2V/2V4L-ABJ/2V4L-ABJ_ligand.pdbqt | data/2V/2V4L-ABJ/2V4L-ABJ_target.pdbqt | data/2V/2V4L-ABJ/2V4L-ABJ_decoys.pdbqt | data/2V/2V4L-ABJ/2V4L-ABJ_decoy_scores.csv |
2VWI-ANP | data/2V/2VWI-ANP/2VWI-ANP_ligand.pdbqt | data/2V/2VWI-ANP/2VWI-ANP_target.pdbqt | null | null |
2VHX-NAD | data/2V/2VHX-NAD/2VHX-NAD_ligand.pdbqt | data/2V/2VHX-NAD/2VHX-NAD_target.pdbqt | data/2V/2VHX-NAD/2VHX-NAD_decoys.pdbqt | data/2V/2VHX-NAD/2VHX-NAD_decoy_scores.csv |
2V2Z-CDM | data/2V/2V2Z-CDM/2V2Z-CDM_ligand.pdbqt | data/2V/2V2Z-CDM/2V2Z-CDM_target.pdbqt | data/2V/2V2Z-CDM/2V2Z-CDM_decoys.pdbqt | data/2V/2V2Z-CDM/2V2Z-CDM_decoy_scores.csv |
2VW2-NHE | data/2V/2VW2-NHE/2VW2-NHE_ligand.pdbqt | data/2V/2VW2-NHE/2VW2-NHE_target.pdbqt | data/2V/2VW2-NHE/2VW2-NHE_decoys.pdbqt | data/2V/2VW2-NHE/2VW2-NHE_decoy_scores.csv |
2VBV-FMN | data/2V/2VBV-FMN/2VBV-FMN_ligand.pdbqt | data/2V/2VBV-FMN/2VBV-FMN_target.pdbqt | data/2V/2VBV-FMN/2VBV-FMN_decoys.pdbqt | data/2V/2VBV-FMN/2VBV-FMN_decoy_scores.csv |
2VV1-4HD | data/2V/2VV1-4HD/2VV1-4HD_ligand.pdbqt | data/2V/2VV1-4HD/2VV1-4HD_target.pdbqt | data/2V/2VV1-4HD/2VV1-4HD_decoys.pdbqt | data/2V/2VV1-4HD/2VV1-4HD_decoy_scores.csv |
2VTE-IK4 | data/2V/2VTE-IK4/2VTE-IK4_ligand.pdbqt | data/2V/2VTE-IK4/2VTE-IK4_target.pdbqt | data/2V/2VTE-IK4/2VTE-IK4_decoys.pdbqt | data/2V/2VTE-IK4/2VTE-IK4_decoy_scores.csv |
2VP3-M7G | data/2V/2VP3-M7G/2VP3-M7G_ligand.pdbqt | data/2V/2VP3-M7G/2VP3-M7G_target.pdbqt | data/2V/2VP3-M7G/2VP3-M7G_decoys.pdbqt | data/2V/2VP3-M7G/2VP3-M7G_decoy_scores.csv |
2V54-TYD | data/2V/2V54-TYD/2V54-TYD_ligand.pdbqt | data/2V/2V54-TYD/2V54-TYD_target.pdbqt | data/2V/2V54-TYD/2V54-TYD_decoys.pdbqt | data/2V/2V54-TYD/2V54-TYD_decoy_scores.csv |
2VWY-7X5 | data/2V/2VWY-7X5/2VWY-7X5_ligand.pdbqt | data/2V/2VWY-7X5/2VWY-7X5_target.pdbqt | data/2V/2VWY-7X5/2VWY-7X5_decoys.pdbqt | data/2V/2VWY-7X5/2VWY-7X5_decoy_scores.csv |
2VPY-PCI | data/2V/2VPY-PCI/2VPY-PCI_ligand.pdbqt | data/2V/2VPY-PCI/2VPY-PCI_target.pdbqt | data/2V/2VPY-PCI/2VPY-PCI_decoys.pdbqt | data/2V/2VPY-PCI/2VPY-PCI_decoy_scores.csv |
2VNP-DED | data/2V/2VNP-DED/2VNP-DED_ligand.pdbqt | data/2V/2VNP-DED/2VNP-DED_target.pdbqt | data/2V/2VNP-DED/2VNP-DED_decoys.pdbqt | data/2V/2VNP-DED/2VNP-DED_decoy_scores.csv |
2VC7-HT5 | data/2V/2VC7-HT5/2VC7-HT5_ligand.pdbqt | data/2V/2VC7-HT5/2VC7-HT5_target.pdbqt | data/2V/2VC7-HT5/2VC7-HT5_decoys.pdbqt | data/2V/2VC7-HT5/2VC7-HT5_decoy_scores.csv |
2V2V-V12 | data/2V/2V2V-V12/2V2V-V12_ligand.pdbqt | data/2V/2V2V-V12/2V2V-V12_target.pdbqt | data/2V/2V2V-V12/2V2V-V12_decoys.pdbqt | data/2V/2V2V-V12/2V2V-V12_decoy_scores.csv |
2VEA-CYC | data/2V/2VEA-CYC/2VEA-CYC_ligand.pdbqt | data/2V/2VEA-CYC/2VEA-CYC_target.pdbqt | data/2V/2VEA-CYC/2VEA-CYC_decoys.pdbqt | data/2V/2VEA-CYC/2VEA-CYC_decoy_scores.csv |
2VZ0-D64 | data/2V/2VZ0-D64/2VZ0-D64_ligand.pdbqt | data/2V/2VZ0-D64/2VZ0-D64_target.pdbqt | data/2V/2VZ0-D64/2VZ0-D64_decoys.pdbqt | data/2V/2VZ0-D64/2VZ0-D64_decoy_scores.csv |
2V0W-FMN | data/2V/2V0W-FMN/2V0W-FMN_ligand.pdbqt | data/2V/2V0W-FMN/2V0W-FMN_target.pdbqt | data/2V/2V0W-FMN/2V0W-FMN_decoys.pdbqt | data/2V/2V0W-FMN/2V0W-FMN_decoy_scores.csv |
2VMC-NGA | data/2V/2VMC-NGA/2VMC-NGA_ligand.pdbqt | data/2V/2VMC-NGA/2VMC-NGA_target.pdbqt | data/2V/2VMC-NGA/2VMC-NGA_decoys.pdbqt | data/2V/2VMC-NGA/2VMC-NGA_decoy_scores.csv |
2VTR-LZB | data/2V/2VTR-LZB/2VTR-LZB_ligand.pdbqt | data/2V/2VTR-LZB/2VTR-LZB_target.pdbqt | data/2V/2VTR-LZB/2VTR-LZB_decoys.pdbqt | data/2V/2VTR-LZB/2VTR-LZB_decoy_scores.csv |
2VXO-XMP | data/2V/2VXO-XMP/2VXO-XMP_ligand.pdbqt | data/2V/2VXO-XMP/2VXO-XMP_target.pdbqt | data/2V/2VXO-XMP/2VXO-XMP_decoys.pdbqt | data/2V/2VXO-XMP/2VXO-XMP_decoy_scores.csv |
2VUD-FUC | data/2V/2VUD-FUC/2VUD-FUC_ligand.pdbqt | data/2V/2VUD-FUC/2VUD-FUC_target.pdbqt | data/2V/2VUD-FUC/2VUD-FUC_decoys.pdbqt | data/2V/2VUD-FUC/2VUD-FUC_decoy_scores.csv |
2VJB-CCD | data/2V/2VJB-CCD/2VJB-CCD_ligand.pdbqt | data/2V/2VJB-CCD/2VJB-CCD_target.pdbqt | data/2V/2VJB-CCD/2VJB-CCD_decoys.pdbqt | data/2V/2VJB-CCD/2VJB-CCD_decoy_scores.csv |
2V4V-XYP | data/2V/2V4V-XYP/2V4V-XYP_ligand.pdbqt | data/2V/2V4V-XYP/2V4V-XYP_target.pdbqt | data/2V/2V4V-XYP/2V4V-XYP_decoys.pdbqt | data/2V/2V4V-XYP/2V4V-XYP_decoy_scores.csv |
2V67-CAP | data/2V/2V67-CAP/2V67-CAP_ligand.pdbqt | data/2V/2V67-CAP/2V67-CAP_target.pdbqt | data/2V/2V67-CAP/2V67-CAP_decoys.pdbqt | data/2V/2V67-CAP/2V67-CAP_decoy_scores.csv |
2VX0-7X7 | data/2V/2VX0-7X7/2VX0-7X7_ligand.pdbqt | data/2V/2VX0-7X7/2VX0-7X7_target.pdbqt | data/2V/2VX0-7X7/2VX0-7X7_decoys.pdbqt | data/2V/2VX0-7X7/2VX0-7X7_decoy_scores.csv |
2VYN-NAD | data/2V/2VYN-NAD/2VYN-NAD_ligand.pdbqt | data/2V/2VYN-NAD/2VYN-NAD_target.pdbqt | data/2V/2VYN-NAD/2VYN-NAD_decoys.pdbqt | data/2V/2VYN-NAD/2VYN-NAD_decoy_scores.csv |
2VSS-V55 | data/2V/2VSS-V55/2VSS-V55_ligand.pdbqt | data/2V/2VSS-V55/2VSS-V55_target.pdbqt | data/2V/2VSS-V55/2VSS-V55_decoys.pdbqt | data/2V/2VSS-V55/2VSS-V55_decoy_scores.csv |
2VLE-DZN | data/2V/2VLE-DZN/2VLE-DZN_ligand.pdbqt | data/2V/2VLE-DZN/2VLE-DZN_target.pdbqt | data/2V/2VLE-DZN/2VLE-DZN_decoys.pdbqt | data/2V/2VLE-DZN/2VLE-DZN_decoy_scores.csv |
2VT2-NAD | data/2V/2VT2-NAD/2VT2-NAD_ligand.pdbqt | data/2V/2VT2-NAD/2VT2-NAD_target.pdbqt | data/2V/2VT2-NAD/2VT2-NAD_decoys.pdbqt | data/2V/2VT2-NAD/2VT2-NAD_decoy_scores.csv |
2V34-CTN | data/2V/2V34-CTN/2V34-CTN_ligand.pdbqt | data/2V/2V34-CTN/2V34-CTN_target.pdbqt | data/2V/2V34-CTN/2V34-CTN_decoys.pdbqt | data/2V/2V34-CTN/2V34-CTN_decoy_scores.csv |
6BFD-DJS | data/6B/6BFD-DJS/6BFD-DJS_ligand.pdbqt | data/6B/6BFD-DJS/6BFD-DJS_target.pdbqt | data/6B/6BFD-DJS/6BFD-DJS_decoys.pdbqt | data/6B/6BFD-DJS/6BFD-DJS_decoy_scores.csv |
6B8B-ADP | data/6B/6B8B-ADP/6B8B-ADP_ligand.pdbqt | data/6B/6B8B-ADP/6B8B-ADP_target.pdbqt | data/6B/6B8B-ADP/6B8B-ADP_decoys.pdbqt | data/6B/6B8B-ADP/6B8B-ADP_decoy_scores.csv |
6BQX-9AG | data/6B/6BQX-9AG/6BQX-9AG_ligand.pdbqt | data/6B/6BQX-9AG/6BQX-9AG_target.pdbqt | data/6B/6BQX-9AG/6BQX-9AG_decoys.pdbqt | data/6B/6BQX-9AG/6BQX-9AG_decoy_scores.csv |
6BKX-ICT | data/6B/6BKX-ICT/6BKX-ICT_ligand.pdbqt | data/6B/6BKX-ICT/6BKX-ICT_target.pdbqt | data/6B/6BKX-ICT/6BKX-ICT_decoys.pdbqt | data/6B/6BKX-ICT/6BKX-ICT_decoy_scores.csv |
6B3T-CJ7 | data/6B/6B3T-CJ7/6B3T-CJ7_ligand.pdbqt | data/6B/6B3T-CJ7/6B3T-CJ7_target.pdbqt | data/6B/6B3T-CJ7/6B3T-CJ7_decoys.pdbqt | data/6B/6B3T-CJ7/6B3T-CJ7_decoy_scores.csv |
6BWL-UDP | data/6B/6BWL-UDP/6BWL-UDP_ligand.pdbqt | data/6B/6BWL-UDP/6BWL-UDP_target.pdbqt | data/6B/6BWL-UDP/6BWL-UDP_decoys.pdbqt | data/6B/6BWL-UDP/6BWL-UDP_decoy_scores.csv |
6BG5-DQD | data/6B/6BG5-DQD/6BG5-DQD_ligand.pdbqt | data/6B/6BG5-DQD/6BG5-DQD_target.pdbqt | data/6B/6BG5-DQD/6BG5-DQD_decoys.pdbqt | data/6B/6BG5-DQD/6BG5-DQD_decoy_scores.csv |
6BC2-DVM | data/6B/6BC2-DVM/6BC2-DVM_ligand.pdbqt | data/6B/6BC2-DVM/6BC2-DVM_target.pdbqt | data/6B/6BC2-DVM/6BC2-DVM_decoys.pdbqt | data/6B/6BC2-DVM/6BC2-DVM_decoy_scores.csv |
6BKL-RIM | data/6B/6BKL-RIM/6BKL-RIM_ligand.pdbqt | data/6B/6BKL-RIM/6BKL-RIM_target.pdbqt | data/6B/6BKL-RIM/6BKL-RIM_decoys.pdbqt | data/6B/6BKL-RIM/6BKL-RIM_decoy_scores.csv |
6B6P-XYP | data/6B/6B6P-XYP/6B6P-XYP_ligand.pdbqt | data/6B/6B6P-XYP/6B6P-XYP_target.pdbqt | data/6B/6B6P-XYP/6B6P-XYP_decoys.pdbqt | data/6B/6B6P-XYP/6B6P-XYP_decoy_scores.csv |
6BMW-DZS | data/6B/6BMW-DZS/6BMW-DZS_ligand.pdbqt | data/6B/6BMW-DZS/6BMW-DZS_target.pdbqt | data/6B/6BMW-DZS/6BMW-DZS_decoys.pdbqt | data/6B/6BMW-DZS/6BMW-DZS_decoy_scores.csv |
6BDP-DE4 | data/6B/6BDP-DE4/6BDP-DE4_ligand.pdbqt | data/6B/6BDP-DE4/6BDP-DE4_target.pdbqt | null | null |
6B89-NOV | data/6B/6B89-NOV/6B89-NOV_ligand.pdbqt | data/6B/6B89-NOV/6B89-NOV_target.pdbqt | data/6B/6B89-NOV/6B89-NOV_decoys.pdbqt | data/6B/6B89-NOV/6B89-NOV_decoy_scores.csv |
6BR1-GTP | data/6B/6BR1-GTP/6BR1-GTP_ligand.pdbqt | data/6B/6BR1-GTP/6BR1-GTP_target.pdbqt | data/6B/6BR1-GTP/6BR1-GTP_decoys.pdbqt | data/6B/6BR1-GTP/6BR1-GTP_decoy_scores.csv |
6BK0-UDP | data/6B/6BK0-UDP/6BK0-UDP_ligand.pdbqt | data/6B/6BK0-UDP/6BK0-UDP_target.pdbqt | data/6B/6BK0-UDP/6BK0-UDP_decoys.pdbqt | data/6B/6BK0-UDP/6BK0-UDP_decoy_scores.csv |
6B0K-9RN | data/6B/6B0K-9RN/6B0K-9RN_ligand.pdbqt | data/6B/6B0K-9RN/6B0K-9RN_target.pdbqt | data/6B/6B0K-9RN/6B0K-9RN_decoys.pdbqt | data/6B/6B0K-9RN/6B0K-9RN_decoy_scores.csv |
6BB2-D4J | data/6B/6BB2-D4J/6BB2-D4J_ligand.pdbqt | data/6B/6BB2-D4J/6BB2-D4J_target.pdbqt | data/6B/6BB2-D4J/6BB2-D4J_decoys.pdbqt | data/6B/6BB2-D4J/6BB2-D4J_decoy_scores.csv |
6BVM-EBV | data/6B/6BVM-EBV/6BVM-EBV_ligand.pdbqt | data/6B/6BVM-EBV/6BVM-EBV_target.pdbqt | data/6B/6BVM-EBV/6BVM-EBV_decoys.pdbqt | data/6B/6BVM-EBV/6BVM-EBV_decoy_scores.csv |
6BQ4-B3P | data/6B/6BQ4-B3P/6BQ4-B3P_ligand.pdbqt | data/6B/6BQ4-B3P/6BQ4-B3P_target.pdbqt | data/6B/6BQ4-B3P/6BQ4-B3P_decoys.pdbqt | data/6B/6BQ4-B3P/6BQ4-B3P_decoy_scores.csv |
6BD7-D7J | data/6B/6BD7-D7J/6BD7-D7J_ligand.pdbqt | data/6B/6BD7-D7J/6BD7-D7J_target.pdbqt | data/6B/6BD7-D7J/6BD7-D7J_decoys.pdbqt | data/6B/6BD7-D7J/6BD7-D7J_decoy_scores.csv |
6BAX-D4S | data/6B/6BAX-D4S/6BAX-D4S_ligand.pdbqt | data/6B/6BAX-D4S/6BAX-D4S_target.pdbqt | data/6B/6BAX-D4S/6BAX-D4S_decoys.pdbqt | data/6B/6BAX-D4S/6BAX-D4S_decoy_scores.csv |
6BDY-SFG | data/6B/6BDY-SFG/6BDY-SFG_ligand.pdbqt | data/6B/6BDY-SFG/6BDY-SFG_target.pdbqt | data/6B/6BDY-SFG/6BDY-SFG_decoys.pdbqt | data/6B/6BDY-SFG/6BDY-SFG_decoy_scores.csv |
6BB0-NAD | data/6B/6BB0-NAD/6BB0-NAD_ligand.pdbqt | data/6B/6BB0-NAD/6BB0-NAD_target.pdbqt | data/6B/6BB0-NAD/6BB0-NAD_decoys.pdbqt | data/6B/6BB0-NAD/6BB0-NAD_decoy_scores.csv |
6B5K-TYD | data/6B/6B5K-TYD/6B5K-TYD_ligand.pdbqt | data/6B/6B5K-TYD/6B5K-TYD_target.pdbqt | data/6B/6B5K-TYD/6B5K-TYD_decoys.pdbqt | data/6B/6B5K-TYD/6B5K-TYD_decoy_scores.csv |
6BAX-NAD | data/6B/6BAX-NAD/6BAX-NAD_ligand.pdbqt | data/6B/6BAX-NAD/6BAX-NAD_target.pdbqt | data/6B/6BAX-NAD/6BAX-NAD_decoys.pdbqt | data/6B/6BAX-NAD/6BAX-NAD_decoy_scores.csv |
6B33-CF7 | data/6B/6B33-CF7/6B33-CF7_ligand.pdbqt | data/6B/6B33-CF7/6B33-CF7_target.pdbqt | data/6B/6B33-CF7/6B33-CF7_decoys.pdbqt | data/6B/6B33-CF7/6B33-CF7_decoy_scores.csv |
6B4Y-OAQ | data/6B/6B4Y-OAQ/6B4Y-OAQ_ligand.pdbqt | data/6B/6B4Y-OAQ/6B4Y-OAQ_target.pdbqt | data/6B/6B4Y-OAQ/6B4Y-OAQ_decoys.pdbqt | data/6B/6B4Y-OAQ/6B4Y-OAQ_decoy_scores.csv |
6BL2-ICT | data/6B/6BL2-ICT/6BL2-ICT_ligand.pdbqt | data/6B/6BL2-ICT/6BL2-ICT_target.pdbqt | data/6B/6BL2-ICT/6BL2-ICT_decoys.pdbqt | data/6B/6BL2-ICT/6BL2-ICT_decoy_scores.csv |
6B5E-DAU | data/6B/6B5E-DAU/6B5E-DAU_ligand.pdbqt | data/6B/6B5E-DAU/6B5E-DAU_target.pdbqt | data/6B/6B5E-DAU/6B5E-DAU_decoys.pdbqt | data/6B/6B5E-DAU/6B5E-DAU_decoy_scores.csv |
6B5E-TYD | data/6B/6B5E-TYD/6B5E-TYD_ligand.pdbqt | data/6B/6B5E-TYD/6B5E-TYD_target.pdbqt | data/6B/6B5E-TYD/6B5E-TYD_decoys.pdbqt | data/6B/6B5E-TYD/6B5E-TYD_decoy_scores.csv |
6BS3-ADP | data/6B/6BS3-ADP/6BS3-ADP_ligand.pdbqt | data/6B/6BS3-ADP/6BS3-ADP_target.pdbqt | data/6B/6BS3-ADP/6BS3-ADP_decoys.pdbqt | data/6B/6BS3-ADP/6BS3-ADP_decoy_scores.csv |
6B6Q-BEN | data/6B/6B6Q-BEN/6B6Q-BEN_ligand.pdbqt | data/6B/6B6Q-BEN/6B6Q-BEN_target.pdbqt | data/6B/6B6Q-BEN/6B6Q-BEN_decoys.pdbqt | data/6B/6B6Q-BEN/6B6Q-BEN_decoy_scores.csv |
6B0Z-C81 | data/6B/6B0Z-C81/6B0Z-C81_ligand.pdbqt | data/6B/6B0Z-C81/6B0Z-C81_target.pdbqt | data/6B/6B0Z-C81/6B0Z-C81_decoys.pdbqt | data/6B/6B0Z-C81/6B0Z-C81_decoy_scores.csv |
6BRJ-VX6 | data/6B/6BRJ-VX6/6BRJ-VX6_ligand.pdbqt | data/6B/6BRJ-VX6/6BRJ-VX6_target.pdbqt | data/6B/6BRJ-VX6/6BRJ-VX6_decoys.pdbqt | data/6B/6BRJ-VX6/6BRJ-VX6_decoy_scores.csv |
6BH1-DQG | data/6B/6BH1-DQG/6BH1-DQG_ligand.pdbqt | data/6B/6BH1-DQG/6BH1-DQG_target.pdbqt | data/6B/6BH1-DQG/6BH1-DQG_decoys.pdbqt | data/6B/6BH1-DQG/6BH1-DQG_decoy_scores.csv |
6BU1-E9S | data/6B/6BU1-E9S/6BU1-E9S_ligand.pdbqt | data/6B/6BU1-E9S/6BU1-E9S_target.pdbqt | data/6B/6BU1-E9S/6BU1-E9S_decoys.pdbqt | data/6B/6BU1-E9S/6BU1-E9S_decoy_scores.csv |
6BZP-TOE | data/6B/6BZP-TOE/6BZP-TOE_ligand.pdbqt | data/6B/6BZP-TOE/6BZP-TOE_target.pdbqt | data/6B/6BZP-TOE/6BZP-TOE_decoys.pdbqt | data/6B/6BZP-TOE/6BZP-TOE_decoy_scores.csv |
6BLB-ADP | data/6B/6BLB-ADP/6BLB-ADP_ligand.pdbqt | data/6B/6BLB-ADP/6BLB-ADP_target.pdbqt | data/6B/6BLB-ADP/6BLB-ADP_decoys.pdbqt | data/6B/6BLB-ADP/6BLB-ADP_decoy_scores.csv |
6B6N-BEN | data/6B/6B6N-BEN/6B6N-BEN_ligand.pdbqt | data/6B/6B6N-BEN/6B6N-BEN_target.pdbqt | data/6B/6B6N-BEN/6B6N-BEN_decoys.pdbqt | data/6B/6B6N-BEN/6B6N-BEN_decoy_scores.csv |
6BKX-DWP | data/6B/6BKX-DWP/6BKX-DWP_ligand.pdbqt | data/6B/6BKX-DWP/6BKX-DWP_target.pdbqt | data/6B/6BKX-DWP/6BKX-DWP_decoys.pdbqt | data/6B/6BKX-DWP/6BKX-DWP_decoy_scores.csv |
6BCA-GSP | data/6B/6BCA-GSP/6BCA-GSP_ligand.pdbqt | data/6B/6BCA-GSP/6BCA-GSP_target.pdbqt | data/6B/6BCA-GSP/6BCA-GSP_decoys.pdbqt | data/6B/6BCA-GSP/6BCA-GSP_decoy_scores.csv |
6BVQ-4AA | data/6B/6BVQ-4AA/6BVQ-4AA_ligand.pdbqt | data/6B/6BVQ-4AA/6BVQ-4AA_target.pdbqt | data/6B/6BVQ-4AA/6BVQ-4AA_decoys.pdbqt | data/6B/6BVQ-4AA/6BVQ-4AA_decoy_scores.csv |
6BS4-AGS | data/6B/6BS4-AGS/6BS4-AGS_ligand.pdbqt | data/6B/6BS4-AGS/6BS4-AGS_target.pdbqt | data/6B/6BS4-AGS/6BS4-AGS_decoys.pdbqt | data/6B/6BS4-AGS/6BS4-AGS_decoy_scores.csv |
6BY3-DGA | data/6B/6BY3-DGA/6BY3-DGA_ligand.pdbqt | data/6B/6BY3-DGA/6BY3-DGA_target.pdbqt | data/6B/6BY3-DGA/6BY3-DGA_decoys.pdbqt | data/6B/6BY3-DGA/6BY3-DGA_decoy_scores.csv |
6BCB-GSP | data/6B/6BCB-GSP/6BCB-GSP_ligand.pdbqt | data/6B/6BCB-GSP/6BCB-GSP_target.pdbqt | data/6B/6BCB-GSP/6BCB-GSP_decoys.pdbqt | data/6B/6BCB-GSP/6BCB-GSP_decoy_scores.csv |
6B98-D07 | data/6B/6B98-D07/6B98-D07_ligand.pdbqt | data/6B/6B98-D07/6B98-D07_target.pdbqt | data/6B/6B98-D07/6B98-D07_decoys.pdbqt | data/6B/6B98-D07/6B98-D07_decoy_scores.csv |
6BN6-XGH | data/6B/6BN6-XGH/6BN6-XGH_ligand.pdbqt | data/6B/6BN6-XGH/6BN6-XGH_target.pdbqt | data/6B/6BN6-XGH/6BN6-XGH_decoys.pdbqt | data/6B/6BN6-XGH/6BN6-XGH_decoy_scores.csv |
6BMY-DYV | data/6B/6BMY-DYV/6BMY-DYV_ligand.pdbqt | data/6B/6BMY-DYV/6BMY-DYV_target.pdbqt | data/6B/6BMY-DYV/6BMY-DYV_decoys.pdbqt | data/6B/6BMY-DYV/6BMY-DYV_decoy_scores.csv |
6BQ4-ADN | data/6B/6BQ4-ADN/6BQ4-ADN_ligand.pdbqt | data/6B/6BQ4-ADN/6BQ4-ADN_target.pdbqt | data/6B/6BQ4-ADN/6BQ4-ADN_decoys.pdbqt | data/6B/6BQ4-ADN/6BQ4-ADN_decoy_scores.csv |
6BFZ-PEP | data/6B/6BFZ-PEP/6BFZ-PEP_ligand.pdbqt | data/6B/6BFZ-PEP/6BFZ-PEP_target.pdbqt | data/6B/6BFZ-PEP/6BFZ-PEP_decoys.pdbqt | data/6B/6BFZ-PEP/6BFZ-PEP_decoy_scores.csv |
6B4H-IHP | data/6B/6B4H-IHP/6B4H-IHP_ligand.pdbqt | data/6B/6B4H-IHP/6B4H-IHP_target.pdbqt | data/6B/6B4H-IHP/6B4H-IHP_decoys.pdbqt | data/6B/6B4H-IHP/6B4H-IHP_decoy_scores.csv |
6BH4-DQS | data/6B/6BH4-DQS/6BH4-DQS_ligand.pdbqt | data/6B/6BH4-DQS/6BH4-DQS_target.pdbqt | data/6B/6BH4-DQS/6BH4-DQS_decoys.pdbqt | data/6B/6BH4-DQS/6BH4-DQS_decoy_scores.csv |
6BMY-5OD | data/6B/6BMY-5OD/6BMY-5OD_ligand.pdbqt | data/6B/6BMY-5OD/6BMY-5OD_target.pdbqt | data/6B/6BMY-5OD/6BMY-5OD_decoys.pdbqt | data/6B/6BMY-5OD/6BMY-5OD_decoy_scores.csv |
6BRL-GLU | data/6B/6BRL-GLU/6BRL-GLU_ligand.pdbqt | data/6B/6BRL-GLU/6BRL-GLU_target.pdbqt | data/6B/6BRL-GLU/6BRL-GLU_decoys.pdbqt | data/6B/6BRL-GLU/6BRL-GLU_decoy_scores.csv |
6B1K-C9G | data/6B/6B1K-C9G/6B1K-C9G_ligand.pdbqt | data/6B/6B1K-C9G/6B1K-C9G_target.pdbqt | data/6B/6B1K-C9G/6B1K-C9G_decoys.pdbqt | data/6B/6B1K-C9G/6B1K-C9G_decoy_scores.csv |
6BVC-PE3 | data/6B/6BVC-PE3/6BVC-PE3_ligand.pdbqt | data/6B/6BVC-PE3/6BVC-PE3_target.pdbqt | data/6B/6BVC-PE3/6BVC-PE3_decoys.pdbqt | data/6B/6BVC-PE3/6BVC-PE3_decoy_scores.csv |
6B3V-ANP | data/6B/6B3V-ANP/6B3V-ANP_ligand.pdbqt | data/6B/6B3V-ANP/6B3V-ANP_target.pdbqt | data/6B/6B3V-ANP/6B3V-ANP_decoys.pdbqt | data/6B/6B3V-ANP/6B3V-ANP_decoy_scores.csv |
6BQC-LOP | data/6B/6BQC-LOP/6BQC-LOP_ligand.pdbqt | data/6B/6BQC-LOP/6BQC-LOP_target.pdbqt | data/6B/6BQC-LOP/6BQC-LOP_decoys.pdbqt | data/6B/6BQC-LOP/6BQC-LOP_decoy_scores.csv |
6BB1-NAD | data/6B/6BB1-NAD/6BB1-NAD_ligand.pdbqt | data/6B/6BB1-NAD/6BB1-NAD_target.pdbqt | data/6B/6BB1-NAD/6BB1-NAD_decoys.pdbqt | data/6B/6BB1-NAD/6BB1-NAD_decoy_scores.csv |
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