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 ⌀ |
|---|---|---|---|---|
7SJI-9IR | data/7S/7SJI-9IR/7SJI-9IR_ligand.pdbqt | data/7S/7SJI-9IR/7SJI-9IR_target.pdbqt | data/7S/7SJI-9IR/7SJI-9IR_decoys.pdbqt | data/7S/7SJI-9IR/7SJI-9IR_decoy_scores.csv |
7SCX-GSP | data/7S/7SCX-GSP/7SCX-GSP_ligand.pdbqt | data/7S/7SCX-GSP/7SCX-GSP_target.pdbqt | data/7S/7SCX-GSP/7SCX-GSP_decoys.pdbqt | data/7S/7SCX-GSP/7SCX-GSP_decoy_scores.csv |
7SEA-8XF | data/7S/7SEA-8XF/7SEA-8XF_ligand.pdbqt | data/7S/7SEA-8XF/7SEA-8XF_target.pdbqt | data/7S/7SEA-8XF/7SEA-8XF_decoys.pdbqt | data/7S/7SEA-8XF/7SEA-8XF_decoy_scores.csv |
7SVT-CI7 | data/7S/7SVT-CI7/7SVT-CI7_ligand.pdbqt | data/7S/7SVT-CI7/7SVT-CI7_target.pdbqt | data/7S/7SVT-CI7/7SVT-CI7_decoys.pdbqt | data/7S/7SVT-CI7/7SVT-CI7_decoy_scores.csv |
7S43-T3Q | data/7S/7S43-T3Q/7S43-T3Q_ligand.pdbqt | data/7S/7S43-T3Q/7S43-T3Q_target.pdbqt | data/7S/7S43-T3Q/7S43-T3Q_decoys.pdbqt | data/7S/7S43-T3Q/7S43-T3Q_decoy_scores.csv |
7SGI-9DL | data/7S/7SGI-9DL/7SGI-9DL_ligand.pdbqt | data/7S/7SGI-9DL/7SGI-9DL_target.pdbqt | data/7S/7SGI-9DL/7SGI-9DL_decoys.pdbqt | data/7S/7SGI-9DL/7SGI-9DL_decoy_scores.csv |
7S5E-5GP | data/7S/7S5E-5GP/7S5E-5GP_ligand.pdbqt | data/7S/7S5E-5GP/7S5E-5GP_target.pdbqt | data/7S/7S5E-5GP/7S5E-5GP_decoys.pdbqt | data/7S/7S5E-5GP/7S5E-5GP_decoy_scores.csv |
7S2H-FLC | data/7S/7S2H-FLC/7S2H-FLC_ligand.pdbqt | data/7S/7S2H-FLC/7S2H-FLC_target.pdbqt | data/7S/7S2H-FLC/7S2H-FLC_decoys.pdbqt | data/7S/7S2H-FLC/7S2H-FLC_decoy_scores.csv |
7SHH-9FT | data/7S/7SHH-9FT/7SHH-9FT_ligand.pdbqt | data/7S/7SHH-9FT/7SHH-9FT_target.pdbqt | data/7S/7SHH-9FT/7SHH-9FT_decoys.pdbqt | data/7S/7SHH-9FT/7SHH-9FT_decoy_scores.csv |
7S4K-HXG | data/7S/7S4K-HXG/7S4K-HXG_ligand.pdbqt | data/7S/7S4K-HXG/7S4K-HXG_target.pdbqt | data/7S/7S4K-HXG/7S4K-HXG_decoys.pdbqt | data/7S/7S4K-HXG/7S4K-HXG_decoy_scores.csv |
3TZA-TZG | data/3T/3TZA-TZG/3TZA-TZG_ligand.pdbqt | data/3T/3TZA-TZG/3TZA-TZG_target.pdbqt | data/3T/3TZA-TZG/3TZA-TZG_decoys.pdbqt | data/3T/3TZA-TZG/3TZA-TZG_decoy_scores.csv |
3TXT-DFP | data/3T/3TXT-DFP/3TXT-DFP_ligand.pdbqt | data/3T/3TXT-DFP/3TXT-DFP_target.pdbqt | data/3T/3TXT-DFP/3TXT-DFP_decoys.pdbqt | data/3T/3TXT-DFP/3TXT-DFP_decoy_scores.csv |
3TUD-FPX | data/3T/3TUD-FPX/3TUD-FPX_ligand.pdbqt | data/3T/3TUD-FPX/3TUD-FPX_target.pdbqt | data/3T/3TUD-FPX/3TUD-FPX_decoys.pdbqt | data/3T/3TUD-FPX/3TUD-FPX_decoy_scores.csv |
3TSO-GNP | data/3T/3TSO-GNP/3TSO-GNP_ligand.pdbqt | data/3T/3TSO-GNP/3TSO-GNP_target.pdbqt | data/3T/3TSO-GNP/3TSO-GNP_decoys.pdbqt | data/3T/3TSO-GNP/3TSO-GNP_decoy_scores.csv |
3T6F-BTN | data/3T/3T6F-BTN/3T6F-BTN_ligand.pdbqt | data/3T/3T6F-BTN/3T6F-BTN_target.pdbqt | data/3T/3T6F-BTN/3T6F-BTN_decoys.pdbqt | data/3T/3T6F-BTN/3T6F-BTN_decoy_scores.csv |
3T11-3T1 | data/3T/3T11-3T1/3T11-3T1_ligand.pdbqt | data/3T/3T11-3T1/3T11-3T1_target.pdbqt | data/3T/3T11-3T1/3T11-3T1_decoys.pdbqt | data/3T/3T11-3T1/3T11-3T1_decoy_scores.csv |
3TKC-FMV | data/3T/3TKC-FMV/3TKC-FMV_ligand.pdbqt | data/3T/3TKC-FMV/3TKC-FMV_target.pdbqt | data/3T/3TKC-FMV/3TKC-FMV_decoys.pdbqt | data/3T/3TKC-FMV/3TKC-FMV_decoy_scores.csv |
3T50-FMN | data/3T/3T50-FMN/3T50-FMN_ligand.pdbqt | data/3T/3T50-FMN/3T50-FMN_target.pdbqt | data/3T/3T50-FMN/3T50-FMN_decoys.pdbqt | data/3T/3T50-FMN/3T50-FMN_decoy_scores.csv |
3TVK-C2E | data/3T/3TVK-C2E/3TVK-C2E_ligand.pdbqt | data/3T/3TVK-C2E/3TVK-C2E_target.pdbqt | data/3T/3TVK-C2E/3TVK-C2E_decoys.pdbqt | data/3T/3TVK-C2E/3TVK-C2E_decoy_scores.csv |
3TQL-ARG | data/3T/3TQL-ARG/3TQL-ARG_ligand.pdbqt | data/3T/3TQL-ARG/3TQL-ARG_target.pdbqt | data/3T/3TQL-ARG/3TQL-ARG_decoys.pdbqt | data/3T/3TQL-ARG/3TQL-ARG_decoy_scores.csv |
3TTZ-07N | data/3T/3TTZ-07N/3TTZ-07N_ligand.pdbqt | data/3T/3TTZ-07N/3TTZ-07N_target.pdbqt | data/3T/3TTZ-07N/3TTZ-07N_decoys.pdbqt | data/3T/3TTZ-07N/3TTZ-07N_decoy_scores.csv |
3TGP-GNP | data/3T/3TGP-GNP/3TGP-GNP_ligand.pdbqt | data/3T/3TGP-GNP/3TGP-GNP_target.pdbqt | data/3T/3TGP-GNP/3TGP-GNP_decoys.pdbqt | data/3T/3TGP-GNP/3TGP-GNP_decoy_scores.csv |
3T42-3T4 | data/3T/3T42-3T4/3T42-3T4_ligand.pdbqt | data/3T/3T42-3T4/3T42-3T4_target.pdbqt | data/3T/3T42-3T4/3T42-3T4_decoys.pdbqt | data/3T/3T42-3T4/3T42-3T4_decoy_scores.csv |
3T6D-HTO | data/3T/3T6D-HTO/3T6D-HTO_ligand.pdbqt | data/3T/3T6D-HTO/3T6D-HTO_target.pdbqt | data/3T/3T6D-HTO/3T6D-HTO_decoys.pdbqt | data/3T/3T6D-HTO/3T6D-HTO_decoy_scores.csv |
3TW3-ATP | data/3T/3TW3-ATP/3TW3-ATP_ligand.pdbqt | data/3T/3TW3-ATP/3TW3-ATP_target.pdbqt | data/3T/3TW3-ATP/3TW3-ATP_decoys.pdbqt | data/3T/3TW3-ATP/3TW3-ATP_decoy_scores.csv |
3TM0-ANP | data/3T/3TM0-ANP/3TM0-ANP_ligand.pdbqt | data/3T/3TM0-ANP/3TM0-ANP_target.pdbqt | data/3T/3TM0-ANP/3TM0-ANP_decoys.pdbqt | data/3T/3TM0-ANP/3TM0-ANP_decoy_scores.csv |
3TPP-5HA | data/3T/3TPP-5HA/3TPP-5HA_ligand.pdbqt | data/3T/3TPP-5HA/3TPP-5HA_target.pdbqt | data/3T/3TPP-5HA/3TPP-5HA_decoys.pdbqt | data/3T/3TPP-5HA/3TPP-5HA_decoy_scores.csv |
3TZF-HH2 | data/3T/3TZF-HH2/3TZF-HH2_ligand.pdbqt | data/3T/3TZF-HH2/3TZF-HH2_target.pdbqt | data/3T/3TZF-HH2/3TZF-HH2_decoys.pdbqt | data/3T/3TZF-HH2/3TZF-HH2_decoy_scores.csv |
3T9X-GLU | data/3T/3T9X-GLU/3T9X-GLU_ligand.pdbqt | data/3T/3T9X-GLU/3T9X-GLU_target.pdbqt | data/3T/3T9X-GLU/3T9X-GLU_decoys.pdbqt | data/3T/3T9X-GLU/3T9X-GLU_decoy_scores.csv |
3T99-ADP | data/3T/3T99-ADP/3T99-ADP_ligand.pdbqt | data/3T/3T99-ADP/3T99-ADP_target.pdbqt | data/3T/3T99-ADP/3T99-ADP_decoys.pdbqt | data/3T/3T99-ADP/3T99-ADP_decoy_scores.csv |
3TPV-ADE | data/3T/3TPV-ADE/3TPV-ADE_ligand.pdbqt | data/3T/3TPV-ADE/3TPV-ADE_target.pdbqt | data/3T/3TPV-ADE/3TPV-ADE_decoys.pdbqt | data/3T/3TPV-ADE/3TPV-ADE_decoy_scores.csv |
3TNT-G85 | data/3T/3TNT-G85/3TNT-G85_ligand.pdbqt | data/3T/3TNT-G85/3TNT-G85_target.pdbqt | data/3T/3TNT-G85/3TNT-G85_decoys.pdbqt | data/3T/3TNT-G85/3TNT-G85_decoy_scores.csv |
3T3R-9PL | data/3T/3T3R-9PL/3T3R-9PL_ligand.pdbqt | data/3T/3T3R-9PL/3T3R-9PL_target.pdbqt | data/3T/3T3R-9PL/3T3R-9PL_decoys.pdbqt | data/3T/3T3R-9PL/3T3R-9PL_decoy_scores.csv |
3T9A-ANP | data/3T/3T9A-ANP/3T9A-ANP_ligand.pdbqt | data/3T/3T9A-ANP/3T9A-ANP_target.pdbqt | data/3T/3T9A-ANP/3T9A-ANP_decoys.pdbqt | data/3T/3T9A-ANP/3T9A-ANP_decoy_scores.csv |
3T93-GLU | data/3T/3T93-GLU/3T93-GLU_ligand.pdbqt | data/3T/3T93-GLU/3T93-GLU_target.pdbqt | data/3T/3T93-GLU/3T93-GLU_decoys.pdbqt | data/3T/3T93-GLU/3T93-GLU_decoy_scores.csv |
3T0G-H6P | data/3T/3T0G-H6P/3T0G-H6P_ligand.pdbqt | data/3T/3T0G-H6P/3T0G-H6P_target.pdbqt | data/3T/3T0G-H6P/3T0G-H6P_decoys.pdbqt | data/3T/3T0G-H6P/3T0G-H6P_decoy_scores.csv |
3T9E-ADP | data/3T/3T9E-ADP/3T9E-ADP_ligand.pdbqt | data/3T/3T9E-ADP/3T9E-ADP_target.pdbqt | data/3T/3T9E-ADP/3T9E-ADP_decoys.pdbqt | data/3T/3T9E-ADP/3T9E-ADP_decoy_scores.csv |
3TQ8-TOP | data/3T/3TQ8-TOP/3TQ8-TOP_ligand.pdbqt | data/3T/3TQ8-TOP/3TQ8-TOP_target.pdbqt | data/3T/3TQ8-TOP/3TQ8-TOP_decoys.pdbqt | data/3T/3TQ8-TOP/3TQ8-TOP_decoy_scores.csv |
3TNS-G83 | data/3T/3TNS-G83/3TNS-G83_ligand.pdbqt | data/3T/3TNS-G83/3TNS-G83_target.pdbqt | data/3T/3TNS-G83/3TNS-G83_decoys.pdbqt | data/3T/3TNS-G83/3TNS-G83_decoy_scores.csv |
3TR0-5GP | data/3T/3TR0-5GP/3TR0-5GP_ligand.pdbqt | data/3T/3TR0-5GP/3TR0-5GP_target.pdbqt | data/3T/3TR0-5GP/3TR0-5GP_decoys.pdbqt | data/3T/3TR0-5GP/3TR0-5GP_decoy_scores.csv |
3TQ0-FMN | data/3T/3TQ0-FMN/3TQ0-FMN_ligand.pdbqt | data/3T/3TQ0-FMN/3TQ0-FMN_target.pdbqt | data/3T/3TQ0-FMN/3TQ0-FMN_decoys.pdbqt | data/3T/3TQ0-FMN/3TQ0-FMN_decoy_scores.csv |
3T03-3T0 | data/3T/3T03-3T0/3T03-3T0_ligand.pdbqt | data/3T/3T03-3T0/3T03-3T0_target.pdbqt | data/3T/3T03-3T0/3T03-3T0_decoys.pdbqt | data/3T/3T03-3T0/3T03-3T0_decoy_scores.csv |
3TXZ-FMN | data/3T/3TXZ-FMN/3TXZ-FMN_ligand.pdbqt | data/3T/3TXZ-FMN/3TXZ-FMN_target.pdbqt | data/3T/3TXZ-FMN/3TXZ-FMN_decoys.pdbqt | data/3T/3TXZ-FMN/3TXZ-FMN_decoy_scores.csv |
3T95-PAV | data/3T/3T95-PAV/3T95-PAV_ligand.pdbqt | data/3T/3T95-PAV/3T95-PAV_target.pdbqt | data/3T/3T95-PAV/3T95-PAV_decoys.pdbqt | data/3T/3T95-PAV/3T95-PAV_decoy_scores.csv |
3TCY-PHE | data/3T/3TCY-PHE/3TCY-PHE_ligand.pdbqt | data/3T/3TCY-PHE/3TCY-PHE_target.pdbqt | data/3T/3TCY-PHE/3TCY-PHE_decoys.pdbqt | data/3T/3TCY-PHE/3TCY-PHE_decoy_scores.csv |
3TFQ-07M | data/3T/3TFQ-07M/3TFQ-07M_ligand.pdbqt | data/3T/3TFQ-07M/3TFQ-07M_target.pdbqt | data/3T/3TFQ-07M/3TFQ-07M_decoys.pdbqt | data/3T/3TFQ-07M/3TFQ-07M_decoy_scores.csv |
3TSC-NAD | data/3T/3TSC-NAD/3TSC-NAD_ligand.pdbqt | data/3T/3TSC-NAD/3TSC-NAD_target.pdbqt | data/3T/3TSC-NAD/3TSC-NAD_decoys.pdbqt | data/3T/3TSC-NAD/3TSC-NAD_decoy_scores.csv |
3TT4-E1S | data/3T/3TT4-E1S/3TT4-E1S_ligand.pdbqt | data/3T/3TT4-E1S/3TT4-E1S_target.pdbqt | data/3T/3TT4-E1S/3TT4-E1S_decoys.pdbqt | data/3T/3TT4-E1S/3TT4-E1S_decoy_scores.csv |
3TZM-085 | data/3T/3TZM-085/3TZM-085_ligand.pdbqt | data/3T/3TZM-085/3TZM-085_target.pdbqt | data/3T/3TZM-085/3TZM-085_decoys.pdbqt | data/3T/3TZM-085/3TZM-085_decoy_scores.csv |
3TWB-GCO | data/3T/3TWB-GCO/3TWB-GCO_ligand.pdbqt | data/3T/3TWB-GCO/3TWB-GCO_target.pdbqt | data/3T/3TWB-GCO/3TWB-GCO_decoys.pdbqt | data/3T/3TWB-GCO/3TWB-GCO_decoy_scores.csv |
3T92-TCE | data/3T/3T92-TCE/3T92-TCE_ligand.pdbqt | data/3T/3T92-TCE/3T92-TCE_target.pdbqt | data/3T/3T92-TCE/3T92-TCE_decoys.pdbqt | data/3T/3T92-TCE/3T92-TCE_decoy_scores.csv |
3TJC-0TP | data/3T/3TJC-0TP/3TJC-0TP_ligand.pdbqt | data/3T/3TJC-0TP/3TJC-0TP_target.pdbqt | data/3T/3TJC-0TP/3TJC-0TP_decoys.pdbqt | data/3T/3TJC-0TP/3TJC-0TP_decoy_scores.csv |
3TDJ-3TJ | data/3T/3TDJ-3TJ/3TDJ-3TJ_ligand.pdbqt | data/3T/3TDJ-3TJ/3TDJ-3TJ_target.pdbqt | data/3T/3TDJ-3TJ/3TDJ-3TJ_decoys.pdbqt | data/3T/3TDJ-3TJ/3TDJ-3TJ_decoy_scores.csv |
3TH4-BGC | data/3T/3TH4-BGC/3TH4-BGC_ligand.pdbqt | data/3T/3TH4-BGC/3TH4-BGC_target.pdbqt | data/3T/3TH4-BGC/3TH4-BGC_decoys.pdbqt | data/3T/3TH4-BGC/3TH4-BGC_decoy_scores.csv |
3TIF-ADP | data/3T/3TIF-ADP/3TIF-ADP_ligand.pdbqt | data/3T/3TIF-ADP/3TIF-ADP_target.pdbqt | data/3T/3TIF-ADP/3TIF-ADP_decoys.pdbqt | data/3T/3TIF-ADP/3TIF-ADP_decoy_scores.csv |
3TE7-TE7 | data/3T/3TE7-TE7/3TE7-TE7_ligand.pdbqt | data/3T/3TE7-TE7/3TE7-TE7_target.pdbqt | data/3T/3TE7-TE7/3TE7-TE7_decoys.pdbqt | data/3T/3TE7-TE7/3TE7-TE7_decoy_scores.csv |
3T0L-1CT | data/3T/3T0L-1CT/3T0L-1CT_ligand.pdbqt | data/3T/3T0L-1CT/3T0L-1CT_target.pdbqt | data/3T/3T0L-1CT/3T0L-1CT_decoys.pdbqt | data/3T/3T0L-1CT/3T0L-1CT_decoy_scores.csv |
3TII-ANP | data/3T/3TII-ANP/3TII-ANP_ligand.pdbqt | data/3T/3TII-ANP/3TII-ANP_target.pdbqt | data/3T/3TII-ANP/3TII-ANP_decoys.pdbqt | data/3T/3TII-ANP/3TII-ANP_decoy_scores.csv |
3T2K-LMT | data/3T/3T2K-LMT/3T2K-LMT_ligand.pdbqt | data/3T/3T2K-LMT/3T2K-LMT_target.pdbqt | data/3T/3T2K-LMT/3T2K-LMT_decoys.pdbqt | data/3T/3T2K-LMT/3T2K-LMT_decoy_scores.csv |
3T9D-ANP | data/3T/3T9D-ANP/3T9D-ANP_ligand.pdbqt | data/3T/3T9D-ANP/3T9D-ANP_target.pdbqt | data/3T/3T9D-ANP/3T9D-ANP_decoys.pdbqt | data/3T/3T9D-ANP/3T9D-ANP_decoy_scores.csv |
3T8H-UBS | data/3T/3T8H-UBS/3T8H-UBS_ligand.pdbqt | data/3T/3T8H-UBS/3T8H-UBS_target.pdbqt | data/3T/3T8H-UBS/3T8H-UBS_decoys.pdbqt | data/3T/3T8H-UBS/3T8H-UBS_decoy_scores.csv |
3T4J-ZIP | data/3T/3T4J-ZIP/3T4J-ZIP_ligand.pdbqt | data/3T/3T4J-ZIP/3T4J-ZIP_target.pdbqt | data/3T/3T4J-ZIP/3T4J-ZIP_decoys.pdbqt | data/3T/3T4J-ZIP/3T4J-ZIP_decoy_scores.csv |
3TOH-079 | data/3T/3TOH-079/3TOH-079_ligand.pdbqt | data/3T/3TOH-079/3TOH-079_target.pdbqt | data/3T/3TOH-079/3TOH-079_decoys.pdbqt | data/3T/3TOH-079/3TOH-079_decoy_scores.csv |
3TVL-3PO | data/3T/3TVL-3PO/3TVL-3PO_ligand.pdbqt | data/3T/3TVL-3PO/3TVL-3PO_target.pdbqt | data/3T/3TVL-3PO/3TVL-3PO_decoys.pdbqt | data/3T/3TVL-3PO/3TVL-3PO_decoy_scores.csv |
3TAX-UDP | data/3T/3TAX-UDP/3TAX-UDP_ligand.pdbqt | data/3T/3TAX-UDP/3TAX-UDP_target.pdbqt | data/3T/3TAX-UDP/3TAX-UDP_decoys.pdbqt | data/3T/3TAX-UDP/3TAX-UDP_decoy_scores.csv |
3TJL-FMN | data/3T/3TJL-FMN/3TJL-FMN_ligand.pdbqt | data/3T/3TJL-FMN/3TJL-FMN_target.pdbqt | data/3T/3TJL-FMN/3TJL-FMN_decoys.pdbqt | data/3T/3TJL-FMN/3TJL-FMN_decoy_scores.csv |
3TOY-P4C | data/3T/3TOY-P4C/3TOY-P4C_ligand.pdbqt | data/3T/3TOY-P4C/3TOY-P4C_target.pdbqt | data/3T/3TOY-P4C/3TOY-P4C_decoys.pdbqt | data/3T/3TOY-P4C/3TOY-P4C_decoy_scores.csv |
3TYM-H4B | data/3T/3TYM-H4B/3TYM-H4B_ligand.pdbqt | data/3T/3TYM-H4B/3TYM-H4B_target.pdbqt | data/3T/3TYM-H4B/3TYM-H4B_decoys.pdbqt | data/3T/3TYM-H4B/3TYM-H4B_decoy_scores.csv |
3TZZ-XPM | data/3T/3TZZ-XPM/3TZZ-XPM_ligand.pdbqt | data/3T/3TZZ-XPM/3TZZ-XPM_target.pdbqt | data/3T/3TZZ-XPM/3TZZ-XPM_decoys.pdbqt | data/3T/3TZZ-XPM/3TZZ-XPM_decoy_scores.csv |
3TP7-THP | data/3T/3TP7-THP/3TP7-THP_ligand.pdbqt | data/3T/3TP7-THP/3TP7-THP_target.pdbqt | data/3T/3TP7-THP/3TP7-THP_decoys.pdbqt | data/3T/3TP7-THP/3TP7-THP_decoy_scores.csv |
3TLK-EB4 | data/3T/3TLK-EB4/3TLK-EB4_ligand.pdbqt | data/3T/3TLK-EB4/3TLK-EB4_target.pdbqt | data/3T/3TLK-EB4/3TLK-EB4_decoys.pdbqt | data/3T/3TLK-EB4/3TLK-EB4_decoy_scores.csv |
3T7V-SAM | data/3T/3T7V-SAM/3T7V-SAM_ligand.pdbqt | data/3T/3T7V-SAM/3T7V-SAM_target.pdbqt | data/3T/3T7V-SAM/3T7V-SAM_decoys.pdbqt | data/3T/3T7V-SAM/3T7V-SAM_decoy_scores.csv |
3TXZ-07V | data/3T/3TXZ-07V/3TXZ-07V_ligand.pdbqt | data/3T/3TXZ-07V/3TXZ-07V_target.pdbqt | data/3T/3TXZ-07V/3TXZ-07V_decoys.pdbqt | data/3T/3TXZ-07V/3TXZ-07V_decoy_scores.csv |
3TIY-TIY | data/3T/3TIY-TIY/3TIY-TIY_ligand.pdbqt | data/3T/3TIY-TIY/3TIY-TIY_target.pdbqt | data/3T/3TIY-TIY/3TIY-TIY_decoys.pdbqt | data/3T/3TIY-TIY/3TIY-TIY_decoy_scores.csv |
3TNW-F18 | data/3T/3TNW-F18/3TNW-F18_ligand.pdbqt | data/3T/3TNW-F18/3TNW-F18_target.pdbqt | data/3T/3TNW-F18/3TNW-F18_decoys.pdbqt | data/3T/3TNW-F18/3TNW-F18_decoy_scores.csv |
3TDV-GDP | data/3T/3TDV-GDP/3TDV-GDP_ligand.pdbqt | data/3T/3TDV-GDP/3TDV-GDP_target.pdbqt | data/3T/3TDV-GDP/3TDV-GDP_decoys.pdbqt | data/3T/3TDV-GDP/3TDV-GDP_decoy_scores.csv |
3TK6-D46 | data/3T/3TK6-D46/3TK6-D46_ligand.pdbqt | data/3T/3TK6-D46/3TK6-D46_target.pdbqt | data/3T/3TK6-D46/3TK6-D46_decoys.pdbqt | data/3T/3TK6-D46/3TK6-D46_decoy_scores.csv |
3TWP-SAL | data/3T/3TWP-SAL/3TWP-SAL_ligand.pdbqt | data/3T/3TWP-SAL/3TWP-SAL_target.pdbqt | data/3T/3TWP-SAL/3TWP-SAL_decoys.pdbqt | data/3T/3TWP-SAL/3TWP-SAL_decoy_scores.csv |
3T2W-BTN | data/3T/3T2W-BTN/3T2W-BTN_ligand.pdbqt | data/3T/3T2W-BTN/3T2W-BTN_target.pdbqt | data/3T/3T2W-BTN/3T2W-BTN_decoys.pdbqt | data/3T/3T2W-BTN/3T2W-BTN_decoy_scores.csv |
3T8N-EDT | data/3T/3T8N-EDT/3T8N-EDT_ligand.pdbqt | data/3T/3T8N-EDT/3T8N-EDT_target.pdbqt | data/3T/3T8N-EDT/3T8N-EDT_decoys.pdbqt | data/3T/3T8N-EDT/3T8N-EDT_decoy_scores.csv |
3TFU-PL8 | data/3T/3TFU-PL8/3TFU-PL8_ligand.pdbqt | data/3T/3TFU-PL8/3TFU-PL8_target.pdbqt | data/3T/3TFU-PL8/3TFU-PL8_decoys.pdbqt | data/3T/3TFU-PL8/3TFU-PL8_decoy_scores.csv |
3TSK-QEG | data/3T/3TSK-QEG/3TSK-QEG_ligand.pdbqt | data/3T/3TSK-QEG/3TSK-QEG_target.pdbqt | data/3T/3TSK-QEG/3TSK-QEG_decoys.pdbqt | data/3T/3TSK-QEG/3TSK-QEG_decoy_scores.csv |
3TYM-08R | data/3T/3TYM-08R/3TYM-08R_ligand.pdbqt | data/3T/3TYM-08R/3TYM-08R_target.pdbqt | data/3T/3TYM-08R/3TYM-08R_decoys.pdbqt | data/3T/3TYM-08R/3TYM-08R_decoy_scores.csv |
3TUH-TUH | data/3T/3TUH-TUH/3TUH-TUH_ligand.pdbqt | data/3T/3TUH-TUH/3TUH-TUH_target.pdbqt | data/3T/3TUH-TUH/3TUH-TUH_decoys.pdbqt | data/3T/3TUH-TUH/3TUH-TUH_decoy_scores.csv |
3TKH-07S | data/3T/3TKH-07S/3TKH-07S_ligand.pdbqt | data/3T/3TKH-07S/3TKH-07S_target.pdbqt | data/3T/3TKH-07S/3TKH-07S_decoys.pdbqt | data/3T/3TKH-07S/3TKH-07S_decoy_scores.csv |
3TTP-017 | data/3T/3TTP-017/3TTP-017_ligand.pdbqt | data/3T/3TTP-017/3TTP-017_target.pdbqt | data/3T/3TTP-017/3TTP-017_decoys.pdbqt | data/3T/3TTP-017/3TTP-017_decoy_scores.csv |
3T78-5RG | data/3T/3T78-5RG/3T78-5RG_ligand.pdbqt | data/3T/3T78-5RG/3T78-5RG_target.pdbqt | data/3T/3T78-5RG/3T78-5RG_decoys.pdbqt | data/3T/3T78-5RG/3T78-5RG_decoy_scores.csv |
3TWV-PE8 | data/3T/3TWV-PE8/3TWV-PE8_ligand.pdbqt | data/3T/3TWV-PE8/3TWV-PE8_target.pdbqt | data/3T/3TWV-PE8/3TWV-PE8_decoys.pdbqt | data/3T/3TWV-PE8/3TWV-PE8_decoy_scores.csv |
3TSU-ANP | data/3T/3TSU-ANP/3TSU-ANP_ligand.pdbqt | data/3T/3TSU-ANP/3TSU-ANP_target.pdbqt | data/3T/3TSU-ANP/3TSU-ANP_decoys.pdbqt | data/3T/3TSU-ANP/3TSU-ANP_decoy_scores.csv |
3TQB-FOL | data/3T/3TQB-FOL/3TQB-FOL_ligand.pdbqt | data/3T/3TQB-FOL/3TQB-FOL_target.pdbqt | data/3T/3TQB-FOL/3TQB-FOL_decoys.pdbqt | data/3T/3TQB-FOL/3TQB-FOL_decoy_scores.csv |
3T8F-UBU | data/3T/3T8F-UBU/3T8F-UBU_ligand.pdbqt | data/3T/3T8F-UBU/3T8F-UBU_target.pdbqt | data/3T/3T8F-UBU/3T8F-UBU_decoys.pdbqt | data/3T/3T8F-UBU/3T8F-UBU_decoy_scores.csv |
3TTC-ADP | data/3T/3TTC-ADP/3TTC-ADP_ligand.pdbqt | data/3T/3TTC-ADP/3TTC-ADP_target.pdbqt | data/3T/3TTC-ADP/3TTC-ADP_decoys.pdbqt | data/3T/3TTC-ADP/3TTC-ADP_decoy_scores.csv |
3TDG-P6G | data/3T/3TDG-P6G/3TDG-P6G_ligand.pdbqt | data/3T/3TDG-P6G/3TDG-P6G_target.pdbqt | data/3T/3TDG-P6G/3TDG-P6G_decoys.pdbqt | data/3T/3TDG-P6G/3TDG-P6G_decoy_scores.csv |
3TBK-ANP | data/3T/3TBK-ANP/3TBK-ANP_ligand.pdbqt | data/3T/3TBK-ANP/3TBK-ANP_target.pdbqt | data/3T/3TBK-ANP/3TBK-ANP_decoys.pdbqt | data/3T/3TBK-ANP/3TBK-ANP_decoy_scores.csv |
3TYN-H4B | data/3T/3TYN-H4B/3TYN-H4B_ligand.pdbqt | data/3T/3TYN-H4B/3TYN-H4B_target.pdbqt | data/3T/3TYN-H4B/3TYN-H4B_decoys.pdbqt | data/3T/3TYN-H4B/3TYN-H4B_decoy_scores.csv |
3T54-ATP | data/3T/3T54-ATP/3T54-ATP_ligand.pdbqt | data/3T/3T54-ATP/3T54-ATP_target.pdbqt | data/3T/3T54-ATP/3T54-ATP_decoys.pdbqt | data/3T/3T54-ATP/3T54-ATP_decoy_scores.csv |
3T4L-ZEA | data/3T/3T4L-ZEA/3T4L-ZEA_ligand.pdbqt | data/3T/3T4L-ZEA/3T4L-ZEA_target.pdbqt | data/3T/3T4L-ZEA/3T4L-ZEA_decoys.pdbqt | data/3T/3T4L-ZEA/3T4L-ZEA_decoy_scores.csv |
3T64-DU3 | data/3T/3T64-DU3/3T64-DU3_ligand.pdbqt | data/3T/3T64-DU3/3T64-DU3_target.pdbqt | data/3T/3T64-DU3/3T64-DU3_decoys.pdbqt | data/3T/3T64-DU3/3T64-DU3_decoy_scores.csv |
3T6F-BSO | data/3T/3T6F-BSO/3T6F-BSO_ligand.pdbqt | data/3T/3T6F-BSO/3T6F-BSO_target.pdbqt | data/3T/3T6F-BSO/3T6F-BSO_decoys.pdbqt | data/3T/3T6F-BSO/3T6F-BSO_decoy_scores.csv |
3T9H-KAI | data/3T/3T9H-KAI/3T9H-KAI_ligand.pdbqt | data/3T/3T9H-KAI/3T9H-KAI_target.pdbqt | data/3T/3T9H-KAI/3T9H-KAI_decoys.pdbqt | data/3T/3T9H-KAI/3T9H-KAI_decoy_scores.csv |
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