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 ⌀ |
|---|---|---|---|---|
3F1Q-BCE | data/3F/3F1Q-BCE/3F1Q-BCE_ligand.pdbqt | data/3F/3F1Q-BCE/3F1Q-BCE_target.pdbqt | data/3F/3F1Q-BCE/3F1Q-BCE_decoys.pdbqt | data/3F/3F1Q-BCE/3F1Q-BCE_decoy_scores.csv |
3FEI-CTM | data/3F/3FEI-CTM/3FEI-CTM_ligand.pdbqt | data/3F/3FEI-CTM/3FEI-CTM_target.pdbqt | data/3F/3FEI-CTM/3FEI-CTM_decoys.pdbqt | data/3F/3FEI-CTM/3FEI-CTM_decoy_scores.csv |
3FH5-24P | data/3F/3FH5-24P/3FH5-24P_ligand.pdbqt | data/3F/3FH5-24P/3FH5-24P_target.pdbqt | null | null |
3FUH-5H1 | data/3F/3FUH-5H1/3FUH-5H1_ligand.pdbqt | data/3F/3FUH-5H1/3FUH-5H1_target.pdbqt | null | null |
3FAZ-NOS | data/3F/3FAZ-NOS/3FAZ-NOS_ligand.pdbqt | data/3F/3FAZ-NOS/3FAZ-NOS_target.pdbqt | data/3F/3FAZ-NOS/3FAZ-NOS_decoys.pdbqt | data/3F/3FAZ-NOS/3FAZ-NOS_decoy_scores.csv |
3FE8-CMJ | data/3F/3FE8-CMJ/3FE8-CMJ_ligand.pdbqt | data/3F/3FE8-CMJ/3FE8-CMJ_target.pdbqt | data/3F/3FE8-CMJ/3FE8-CMJ_decoys.pdbqt | data/3F/3FE8-CMJ/3FE8-CMJ_decoy_scores.csv |
3FI4-FI4 | data/3F/3FI4-FI4/3FI4-FI4_ligand.pdbqt | data/3F/3FI4-FI4/3FI4-FI4_target.pdbqt | data/3F/3FI4-FI4/3FI4-FI4_decoys.pdbqt | data/3F/3FI4-FI4/3FI4-FI4_decoy_scores.csv |
3FGO-ACP | data/3F/3FGO-ACP/3FGO-ACP_ligand.pdbqt | data/3F/3FGO-ACP/3FGO-ACP_target.pdbqt | data/3F/3FGO-ACP/3FGO-ACP_decoys.pdbqt | data/3F/3FGO-ACP/3FGO-ACP_decoy_scores.csv |
3FVP-UB2 | data/3F/3FVP-UB2/3FVP-UB2_ligand.pdbqt | data/3F/3FVP-UB2/3FVP-UB2_target.pdbqt | data/3F/3FVP-UB2/3FVP-UB2_decoys.pdbqt | data/3F/3FVP-UB2/3FVP-UB2_decoy_scores.csv |
3FCK-FCK | data/3F/3FCK-FCK/3FCK-FCK_ligand.pdbqt | data/3F/3FCK-FCK/3FCK-FCK_target.pdbqt | data/3F/3FCK-FCK/3FCK-FCK_decoys.pdbqt | data/3F/3FCK-FCK/3FCK-FCK_decoy_scores.csv |
3F6B-8PA | data/3F/3F6B-8PA/3F6B-8PA_ligand.pdbqt | data/3F/3F6B-8PA/3F6B-8PA_target.pdbqt | data/3F/3F6B-8PA/3F6B-8PA_decoys.pdbqt | data/3F/3F6B-8PA/3F6B-8PA_decoy_scores.csv |
3FJZ-GPF | data/3F/3FJZ-GPF/3FJZ-GPF_ligand.pdbqt | data/3F/3FJZ-GPF/3FJZ-GPF_target.pdbqt | data/3F/3FJZ-GPF/3FJZ-GPF_decoys.pdbqt | data/3F/3FJZ-GPF/3FJZ-GPF_decoy_scores.csv |
3F3Y-4OA | data/3F/3F3Y-4OA/3F3Y-4OA_ligand.pdbqt | data/3F/3F3Y-4OA/3F3Y-4OA_target.pdbqt | data/3F/3F3Y-4OA/3F3Y-4OA_decoys.pdbqt | data/3F/3F3Y-4OA/3F3Y-4OA_decoy_scores.csv |
3FQQ-0BD | data/3F/3FQQ-0BD/3FQQ-0BD_ligand.pdbqt | data/3F/3FQQ-0BD/3FQQ-0BD_target.pdbqt | data/3F/3FQQ-0BD/3FQQ-0BD_decoys.pdbqt | data/3F/3FQQ-0BD/3FQQ-0BD_decoy_scores.csv |
3FKQ-ATP | data/3F/3FKQ-ATP/3FKQ-ATP_ligand.pdbqt | data/3F/3FKQ-ATP/3FKQ-ATP_target.pdbqt | data/3F/3FKQ-ATP/3FKQ-ATP_decoys.pdbqt | data/3F/3FKQ-ATP/3FKQ-ATP_decoy_scores.csv |
3F7G-389 | data/3F/3F7G-389/3F7G-389_ligand.pdbqt | data/3F/3F7G-389/3F7G-389_target.pdbqt | data/3F/3F7G-389/3F7G-389_decoys.pdbqt | data/3F/3F7G-389/3F7G-389_decoy_scores.csv |
3FRB-TOP | data/3F/3FRB-TOP/3FRB-TOP_ligand.pdbqt | data/3F/3FRB-TOP/3FRB-TOP_target.pdbqt | data/3F/3FRB-TOP/3FRB-TOP_decoys.pdbqt | data/3F/3FRB-TOP/3FRB-TOP_decoy_scores.csv |
3FXW-F10 | data/3F/3FXW-F10/3FXW-F10_ligand.pdbqt | data/3F/3FXW-F10/3FXW-F10_target.pdbqt | data/3F/3FXW-F10/3FXW-F10_decoys.pdbqt | data/3F/3FXW-F10/3FXW-F10_decoy_scores.csv |
3FVG-MS8 | data/3F/3FVG-MS8/3FVG-MS8_ligand.pdbqt | data/3F/3FVG-MS8/3FVG-MS8_target.pdbqt | data/3F/3FVG-MS8/3FVG-MS8_decoys.pdbqt | data/3F/3FVG-MS8/3FVG-MS8_decoy_scores.csv |
3F0M-BLA | data/3F/3F0M-BLA/3F0M-BLA_ligand.pdbqt | data/3F/3F0M-BLA/3F0M-BLA_target.pdbqt | data/3F/3F0M-BLA/3F0M-BLA_decoys.pdbqt | data/3F/3F0M-BLA/3F0M-BLA_decoy_scores.csv |
3FUJ-00G | data/3F/3FUJ-00G/3FUJ-00G_ligand.pdbqt | data/3F/3FUJ-00G/3FUJ-00G_target.pdbqt | null | null |
3FGC-FMN | data/3F/3FGC-FMN/3FGC-FMN_ligand.pdbqt | data/3F/3FGC-FMN/3FGC-FMN_target.pdbqt | data/3F/3FGC-FMN/3FGC-FMN_decoys.pdbqt | data/3F/3FGC-FMN/3FGC-FMN_decoy_scores.csv |
3FC6-LX2 | data/3F/3FC6-LX2/3FC6-LX2_ligand.pdbqt | data/3F/3FC6-LX2/3FC6-LX2_target.pdbqt | data/3F/3FC6-LX2/3FC6-LX2_decoys.pdbqt | data/3F/3FC6-LX2/3FC6-LX2_decoy_scores.csv |
3F6E-8PA | data/3F/3F6E-8PA/3F6E-8PA_ligand.pdbqt | data/3F/3F6E-8PA/3F6E-8PA_target.pdbqt | data/3F/3F6E-8PA/3F6E-8PA_decoys.pdbqt | data/3F/3F6E-8PA/3F6E-8PA_decoy_scores.csv |
3F8A-B3P | data/3F/3F8A-B3P/3F8A-B3P_ligand.pdbqt | data/3F/3F8A-B3P/3F8A-B3P_target.pdbqt | data/3F/3F8A-B3P/3F8A-B3P_decoys.pdbqt | data/3F/3F8A-B3P/3F8A-B3P_decoy_scores.csv |
3FYV-XCF | data/3F/3FYV-XCF/3FYV-XCF_ligand.pdbqt | data/3F/3FYV-XCF/3FYV-XCF_target.pdbqt | data/3F/3FYV-XCF/3FYV-XCF_decoys.pdbqt | data/3F/3FYV-XCF/3FYV-XCF_decoy_scores.csv |
3F1A-HS7 | data/3F/3F1A-HS7/3F1A-HS7_ligand.pdbqt | data/3F/3F1A-HS7/3F1A-HS7_target.pdbqt | data/3F/3F1A-HS7/3F1A-HS7_decoys.pdbqt | data/3F/3F1A-HS7/3F1A-HS7_decoy_scores.csv |
3FW3-GLC | data/3F/3FW3-GLC/3FW3-GLC_ligand.pdbqt | data/3F/3FW3-GLC/3FW3-GLC_target.pdbqt | data/3F/3FW3-GLC/3FW3-GLC_decoys.pdbqt | data/3F/3FW3-GLC/3FW3-GLC_decoy_scores.csv |
3FDZ-DG2 | data/3F/3FDZ-DG2/3FDZ-DG2_ligand.pdbqt | data/3F/3FDZ-DG2/3FDZ-DG2_target.pdbqt | data/3F/3FDZ-DG2/3FDZ-DG2_decoys.pdbqt | data/3F/3FDZ-DG2/3FDZ-DG2_decoy_scores.csv |
3FKB-TNM | data/3F/3FKB-TNM/3FKB-TNM_ligand.pdbqt | data/3F/3FKB-TNM/3FKB-TNM_target.pdbqt | data/3F/3FKB-TNM/3FKB-TNM_decoys.pdbqt | data/3F/3FKB-TNM/3FKB-TNM_decoy_scores.csv |
3FMN-530 | data/3F/3FMN-530/3FMN-530_ligand.pdbqt | data/3F/3FMN-530/3FMN-530_target.pdbqt | data/3F/3FMN-530/3FMN-530_decoys.pdbqt | data/3F/3FMN-530/3FMN-530_decoy_scores.csv |
3FVQ-ATP | data/3F/3FVQ-ATP/3FVQ-ATP_ligand.pdbqt | data/3F/3FVQ-ATP/3FVQ-ATP_target.pdbqt | data/3F/3FVQ-ATP/3FVQ-ATP_decoys.pdbqt | data/3F/3FVQ-ATP/3FVQ-ATP_decoy_scores.csv |
3FQO-N22 | data/3F/3FQO-N22/3FQO-N22_ligand.pdbqt | data/3F/3FQO-N22/3FQO-N22_target.pdbqt | data/3F/3FQO-N22/3FQO-N22_decoys.pdbqt | data/3F/3FQO-N22/3FQO-N22_decoy_scores.csv |
3F33-PFL | data/3F/3F33-PFL/3F33-PFL_ligand.pdbqt | data/3F/3F33-PFL/3F33-PFL_target.pdbqt | data/3F/3F33-PFL/3F33-PFL_decoys.pdbqt | data/3F/3F33-PFL/3F33-PFL_decoy_scores.csv |
3F3C-PFF | data/3F/3F3C-PFF/3F3C-PFF_ligand.pdbqt | data/3F/3F3C-PFF/3F3C-PFF_target.pdbqt | data/3F/3F3C-PFF/3F3C-PFF_decoys.pdbqt | data/3F/3F3C-PFF/3F3C-PFF_decoy_scores.csv |
3FNE-8PC | data/3F/3FNE-8PC/3FNE-8PC_ligand.pdbqt | data/3F/3FNE-8PC/3FNE-8PC_target.pdbqt | data/3F/3FNE-8PC/3FNE-8PC_decoys.pdbqt | data/3F/3FNE-8PC/3FNE-8PC_decoy_scores.csv |
3FE6-CMJ | data/3F/3FE6-CMJ/3FE6-CMJ_ligand.pdbqt | data/3F/3FE6-CMJ/3FE6-CMJ_target.pdbqt | data/3F/3FE6-CMJ/3FE6-CMJ_decoys.pdbqt | data/3F/3FE6-CMJ/3FE6-CMJ_decoy_scores.csv |
3FYE-DMU | data/3F/3FYE-DMU/3FYE-DMU_ligand.pdbqt | data/3F/3FYE-DMU/3FYE-DMU_target.pdbqt | data/3F/3FYE-DMU/3FYE-DMU_decoys.pdbqt | data/3F/3FYE-DMU/3FYE-DMU_decoy_scores.csv |
3FRF-XCF | data/3F/3FRF-XCF/3FRF-XCF_ligand.pdbqt | data/3F/3FRF-XCF/3FRF-XCF_target.pdbqt | data/3F/3FRF-XCF/3FRF-XCF_decoys.pdbqt | data/3F/3FRF-XCF/3FRF-XCF_decoy_scores.csv |
3F0T-NCV | data/3F/3F0T-NCV/3F0T-NCV_ligand.pdbqt | data/3F/3F0T-NCV/3F0T-NCV_target.pdbqt | data/3F/3F0T-NCV/3F0T-NCV_decoys.pdbqt | data/3F/3F0T-NCV/3F0T-NCV_decoy_scores.csv |
3F3M-PPS | data/3F/3F3M-PPS/3F3M-PPS_ligand.pdbqt | data/3F/3F3M-PPS/3F3M-PPS_target.pdbqt | data/3F/3F3M-PPS/3F3M-PPS_decoys.pdbqt | data/3F/3F3M-PPS/3F3M-PPS_decoy_scores.csv |
3FWG-CAM | data/3F/3FWG-CAM/3FWG-CAM_ligand.pdbqt | data/3F/3FWG-CAM/3FWG-CAM_target.pdbqt | data/3F/3FWG-CAM/3FWG-CAM_decoys.pdbqt | data/3F/3FWG-CAM/3FWG-CAM_decoy_scores.csv |
3FZ1-B98 | data/3F/3FZ1-B98/3FZ1-B98_ligand.pdbqt | data/3F/3FZ1-B98/3FZ1-B98_target.pdbqt | data/3F/3FZ1-B98/3FZ1-B98_decoys.pdbqt | data/3F/3FZ1-B98/3FZ1-B98_decoy_scores.csv |
3FG5-AJM | data/3F/3FG5-AJM/3FG5-AJM_ligand.pdbqt | data/3F/3FG5-AJM/3FG5-AJM_target.pdbqt | data/3F/3FG5-AJM/3FG5-AJM_decoys.pdbqt | data/3F/3FG5-AJM/3FG5-AJM_decoy_scores.csv |
3FIT-FRU | data/3F/3FIT-FRU/3FIT-FRU_ligand.pdbqt | data/3F/3FIT-FRU/3FIT-FRU_target.pdbqt | data/3F/3FIT-FRU/3FIT-FRU_decoys.pdbqt | data/3F/3FIT-FRU/3FIT-FRU_decoy_scores.csv |
3FBB-UDP | data/3F/3FBB-UDP/3FBB-UDP_ligand.pdbqt | data/3F/3FBB-UDP/3FBB-UDP_target.pdbqt | data/3F/3FBB-UDP/3FBB-UDP_decoys.pdbqt | data/3F/3FBB-UDP/3FBB-UDP_decoy_scores.csv |
3FYI-HTO | data/3F/3FYI-HTO/3FYI-HTO_ligand.pdbqt | data/3F/3FYI-HTO/3FYI-HTO_target.pdbqt | data/3F/3FYI-HTO/3FYI-HTO_decoys.pdbqt | data/3F/3FYI-HTO/3FYI-HTO_decoy_scores.csv |
3F5V-P6G | data/3F/3F5V-P6G/3F5V-P6G_ligand.pdbqt | data/3F/3F5V-P6G/3F5V-P6G_target.pdbqt | data/3F/3F5V-P6G/3F5V-P6G_decoys.pdbqt | data/3F/3F5V-P6G/3F5V-P6G_decoy_scores.csv |
3F1S-FLC | data/3F/3F1S-FLC/3F1S-FLC_ligand.pdbqt | data/3F/3F1S-FLC/3F1S-FLC_target.pdbqt | data/3F/3F1S-FLC/3F1S-FLC_decoys.pdbqt | data/3F/3F1S-FLC/3F1S-FLC_decoy_scores.csv |
3FCV-DUD | data/3F/3FCV-DUD/3FCV-DUD_ligand.pdbqt | data/3F/3FCV-DUD/3FCV-DUD_target.pdbqt | data/3F/3FCV-DUD/3FCV-DUD_decoys.pdbqt | data/3F/3FCV-DUD/3FCV-DUD_decoy_scores.csv |
3F9C-DFP | data/3F/3F9C-DFP/3F9C-DFP_ligand.pdbqt | data/3F/3F9C-DFP/3F9C-DFP_target.pdbqt | data/3F/3F9C-DFP/3F9C-DFP_decoys.pdbqt | data/3F/3F9C-DFP/3F9C-DFP_decoy_scores.csv |
3FRJ-A49 | data/3F/3FRJ-A49/3FRJ-A49_ligand.pdbqt | data/3F/3FRJ-A49/3FRJ-A49_target.pdbqt | data/3F/3FRJ-A49/3FRJ-A49_decoys.pdbqt | data/3F/3FRJ-A49/3FRJ-A49_decoy_scores.csv |
3FYZ-MXC | data/3F/3FYZ-MXC/3FYZ-MXC_ligand.pdbqt | data/3F/3FYZ-MXC/3FYZ-MXC_target.pdbqt | data/3F/3FYZ-MXC/3FYZ-MXC_decoys.pdbqt | data/3F/3FYZ-MXC/3FYZ-MXC_decoy_scores.csv |
3FUK-58Z | data/3F/3FUK-58Z/3FUK-58Z_ligand.pdbqt | data/3F/3FUK-58Z/3FUK-58Z_target.pdbqt | null | null |
3FUG-2E3 | data/3F/3FUG-2E3/3FUG-2E3_ligand.pdbqt | data/3F/3FUG-2E3/3FUG-2E3_target.pdbqt | data/3F/3FUG-2E3/3FUG-2E3_decoys.pdbqt | data/3F/3FUG-2E3/3FUG-2E3_decoy_scores.csv |
3FMJ-FMJ | data/3F/3FMJ-FMJ/3FMJ-FMJ_ligand.pdbqt | data/3F/3FMJ-FMJ/3FMJ-FMJ_target.pdbqt | data/3F/3FMJ-FMJ/3FMJ-FMJ_decoys.pdbqt | data/3F/3FMJ-FMJ/3FMJ-FMJ_decoy_scores.csv |
3F0B-53R | data/3F/3F0B-53R/3F0B-53R_ligand.pdbqt | data/3F/3F0B-53R/3F0B-53R_target.pdbqt | data/3F/3F0B-53R/3F0B-53R_decoys.pdbqt | data/3F/3F0B-53R/3F0B-53R_decoy_scores.csv |
3FZY-IHP | data/3F/3FZY-IHP/3FZY-IHP_ligand.pdbqt | data/3F/3FZY-IHP/3FZY-IHP_target.pdbqt | data/3F/3FZY-IHP/3FZY-IHP_decoys.pdbqt | data/3F/3FZY-IHP/3FZY-IHP_decoy_scores.csv |
3F1O-2XY | data/3F/3F1O-2XY/3F1O-2XY_ligand.pdbqt | data/3F/3F1O-2XY/3F1O-2XY_target.pdbqt | data/3F/3F1O-2XY/3F1O-2XY_decoys.pdbqt | data/3F/3F1O-2XY/3F1O-2XY_decoy_scores.csv |
3F03-FMN | data/3F/3F03-FMN/3F03-FMN_ligand.pdbqt | data/3F/3F03-FMN/3F03-FMN_target.pdbqt | data/3F/3F03-FMN/3F03-FMN_decoys.pdbqt | data/3F/3F03-FMN/3F03-FMN_decoy_scores.csv |
3FZG-SAM | data/3F/3FZG-SAM/3FZG-SAM_ligand.pdbqt | data/3F/3FZG-SAM/3FZG-SAM_target.pdbqt | data/3F/3FZG-SAM/3FZG-SAM_decoys.pdbqt | data/3F/3FZG-SAM/3FZG-SAM_decoy_scores.csv |
3F0F-C5P | data/3F/3F0F-C5P/3F0F-C5P_ligand.pdbqt | data/3F/3F0F-C5P/3F0F-C5P_target.pdbqt | data/3F/3F0F-C5P/3F0F-C5P_decoys.pdbqt | data/3F/3F0F-C5P/3F0F-C5P_decoy_scores.csv |
3FPA-DTB | data/3F/3FPA-DTB/3FPA-DTB_ligand.pdbqt | data/3F/3FPA-DTB/3FPA-DTB_target.pdbqt | data/3F/3FPA-DTB/3FPA-DTB_decoys.pdbqt | data/3F/3FPA-DTB/3FPA-DTB_decoy_scores.csv |
3FDZ-3PG | data/3F/3FDZ-3PG/3FDZ-3PG_ligand.pdbqt | data/3F/3FDZ-3PG/3FDZ-3PG_target.pdbqt | data/3F/3FDZ-3PG/3FDZ-3PG_decoys.pdbqt | data/3F/3FDZ-3PG/3FDZ-3PG_decoy_scores.csv |
3F2A-985 | data/3F/3F2A-985/3F2A-985_ligand.pdbqt | data/3F/3F2A-985/3F2A-985_target.pdbqt | data/3F/3F2A-985/3F2A-985_decoys.pdbqt | data/3F/3F2A-985/3F2A-985_decoy_scores.csv |
3F3A-C14 | data/3F/3F3A-C14/3F3A-C14_ligand.pdbqt | data/3F/3F3A-C14/3F3A-C14_target.pdbqt | data/3F/3F3A-C14/3F3A-C14_decoys.pdbqt | data/3F/3F3A-C14/3F3A-C14_decoy_scores.csv |
3FPH-GLU | data/3F/3FPH-GLU/3FPH-GLU_ligand.pdbqt | data/3F/3FPH-GLU/3FPH-GLU_target.pdbqt | data/3F/3FPH-GLU/3FPH-GLU_decoys.pdbqt | data/3F/3FPH-GLU/3FPH-GLU_decoy_scores.csv |
3FAL-REA | data/3F/3FAL-REA/3FAL-REA_ligand.pdbqt | data/3F/3FAL-REA/3FAL-REA_target.pdbqt | data/3F/3FAL-REA/3FAL-REA_decoys.pdbqt | data/3F/3FAL-REA/3FAL-REA_decoy_scores.csv |
3FK0-S3P | data/3F/3FK0-S3P/3FK0-S3P_ligand.pdbqt | data/3F/3FK0-S3P/3FK0-S3P_target.pdbqt | data/3F/3FK0-S3P/3FK0-S3P_decoys.pdbqt | data/3F/3FK0-S3P/3FK0-S3P_decoy_scores.csv |
3F0Q-52V | data/3F/3F0Q-52V/3F0Q-52V_ligand.pdbqt | data/3F/3F0Q-52V/3F0Q-52V_target.pdbqt | data/3F/3F0Q-52V/3F0Q-52V_decoys.pdbqt | data/3F/3F0Q-52V/3F0Q-52V_decoy_scores.csv |
3F2R-HC6 | data/3F/3F2R-HC6/3F2R-HC6_ligand.pdbqt | data/3F/3F2R-HC6/3F2R-HC6_target.pdbqt | data/3F/3F2R-HC6/3F2R-HC6_decoys.pdbqt | data/3F/3F2R-HC6/3F2R-HC6_decoy_scores.csv |
3F0U-53R | data/3F/3F0U-53R/3F0U-53R_ligand.pdbqt | data/3F/3F0U-53R/3F0U-53R_target.pdbqt | data/3F/3F0U-53R/3F0U-53R_decoys.pdbqt | data/3F/3F0U-53R/3F0U-53R_decoy_scores.csv |
3FJL-FMN | data/3F/3FJL-FMN/3FJL-FMN_ligand.pdbqt | data/3F/3FJL-FMN/3FJL-FMN_target.pdbqt | data/3F/3FJL-FMN/3FJL-FMN_decoys.pdbqt | data/3F/3FJL-FMN/3FJL-FMN_decoy_scores.csv |
3FX5-KNI | data/3F/3FX5-KNI/3FX5-KNI_ligand.pdbqt | data/3F/3FX5-KNI/3FX5-KNI_target.pdbqt | data/3F/3FX5-KNI/3FX5-KNI_decoys.pdbqt | data/3F/3FX5-KNI/3FX5-KNI_decoy_scores.csv |
3FU0-22F | data/3F/3FU0-22F/3FU0-22F_ligand.pdbqt | data/3F/3FU0-22F/3FU0-22F_target.pdbqt | null | null |
3FRO-NHF | data/3F/3FRO-NHF/3FRO-NHF_ligand.pdbqt | data/3F/3FRO-NHF/3FRO-NHF_target.pdbqt | data/3F/3FRO-NHF/3FRO-NHF_decoys.pdbqt | data/3F/3FRO-NHF/3FRO-NHF_decoy_scores.csv |
3FO3-PG6 | data/3F/3FO3-PG6/3FO3-PG6_ligand.pdbqt | data/3F/3FO3-PG6/3FO3-PG6_target.pdbqt | data/3F/3FO3-PG6/3FO3-PG6_decoys.pdbqt | data/3F/3FO3-PG6/3FO3-PG6_decoy_scores.csv |
3FQF-55V | data/3F/3FQF-55V/3FQF-55V_ligand.pdbqt | data/3F/3FQF-55V/3FQF-55V_target.pdbqt | data/3F/3FQF-55V/3FQF-55V_decoys.pdbqt | data/3F/3FQF-55V/3FQF-55V_decoy_scores.csv |
3FSB-T3Q | data/3F/3FSB-T3Q/3FSB-T3Q_ligand.pdbqt | data/3F/3FSB-T3Q/3FSB-T3Q_target.pdbqt | data/3F/3FSB-T3Q/3FSB-T3Q_decoys.pdbqt | data/3F/3FSB-T3Q/3FSB-T3Q_decoy_scores.csv |
3FX2-FMN | data/3F/3FX2-FMN/3FX2-FMN_ligand.pdbqt | data/3F/3FX2-FMN/3FX2-FMN_target.pdbqt | data/3F/3FX2-FMN/3FX2-FMN_decoys.pdbqt | data/3F/3FX2-FMN/3FX2-FMN_decoy_scores.csv |
3FRZ-AG0 | data/3F/3FRZ-AG0/3FRZ-AG0_ligand.pdbqt | data/3F/3FRZ-AG0/3FRZ-AG0_target.pdbqt | data/3F/3FRZ-AG0/3FRZ-AG0_decoys.pdbqt | data/3F/3FRZ-AG0/3FRZ-AG0_decoy_scores.csv |
3FR4-F8A | data/3F/3FR4-F8A/3FR4-F8A_ligand.pdbqt | data/3F/3FR4-F8A/3FR4-F8A_target.pdbqt | data/3F/3FR4-F8A/3FR4-F8A_decoys.pdbqt | data/3F/3FR4-F8A/3FR4-F8A_decoy_scores.csv |
3F9M-MRK | data/3F/3F9M-MRK/3F9M-MRK_ligand.pdbqt | data/3F/3F9M-MRK/3F9M-MRK_target.pdbqt | data/3F/3F9M-MRK/3F9M-MRK_decoys.pdbqt | data/3F/3F9M-MRK/3F9M-MRK_decoy_scores.csv |
3FV7-MXS | data/3F/3FV7-MXS/3FV7-MXS_ligand.pdbqt | data/3F/3FV7-MXS/3FV7-MXS_target.pdbqt | data/3F/3FV7-MXS/3FV7-MXS_decoys.pdbqt | data/3F/3FV7-MXS/3FV7-MXS_decoy_scores.csv |
3F0G-C5P | data/3F/3F0G-C5P/3F0G-C5P_ligand.pdbqt | data/3F/3F0G-C5P/3F0G-C5P_target.pdbqt | data/3F/3F0G-C5P/3F0G-C5P_decoys.pdbqt | data/3F/3F0G-C5P/3F0G-C5P_decoy_scores.csv |
3FQL-79Z | data/3F/3FQL-79Z/3FQL-79Z_ligand.pdbqt | data/3F/3FQL-79Z/3FQL-79Z_target.pdbqt | data/3F/3FQL-79Z/3FQL-79Z_decoys.pdbqt | data/3F/3FQL-79Z/3FQL-79Z_decoy_scores.csv |
3F5U-ANP | data/3F/3F5U-ANP/3F5U-ANP_ligand.pdbqt | data/3F/3F5U-ANP/3F5U-ANP_target.pdbqt | data/3F/3F5U-ANP/3F5U-ANP_decoys.pdbqt | data/3F/3F5U-ANP/3F5U-ANP_decoy_scores.csv |
3F3Z-DRK | data/3F/3F3Z-DRK/3F3Z-DRK_ligand.pdbqt | data/3F/3F3Z-DRK/3F3Z-DRK_target.pdbqt | data/3F/3F3Z-DRK/3F3Z-DRK_decoys.pdbqt | data/3F/3F3Z-DRK/3F3Z-DRK_decoy_scores.csv |
3F7I-BTB | data/3F/3F7I-BTB/3F7I-BTB_ligand.pdbqt | data/3F/3F7I-BTB/3F7I-BTB_target.pdbqt | null | null |
3FJL-CJH | data/3F/3FJL-CJH/3FJL-CJH_ligand.pdbqt | data/3F/3FJL-CJH/3FJL-CJH_target.pdbqt | data/3F/3FJL-CJH/3FJL-CJH_decoys.pdbqt | data/3F/3FJL-CJH/3FJL-CJH_decoy_scores.csv |
3FXP-D38 | data/3F/3FXP-D38/3FXP-D38_ligand.pdbqt | data/3F/3FXP-D38/3FXP-D38_target.pdbqt | data/3F/3FXP-D38/3FXP-D38_decoys.pdbqt | data/3F/3FXP-D38/3FXP-D38_decoy_scores.csv |
3FZL-3FD | data/3F/3FZL-3FD/3FZL-3FD_ligand.pdbqt | data/3F/3FZL-3FD/3FZL-3FD_target.pdbqt | data/3F/3FZL-3FD/3FZL-3FD_decoys.pdbqt | data/3F/3FZL-3FD/3FZL-3FD_decoy_scores.csv |
3FHE-28P | data/3F/3FHE-28P/3FHE-28P_ligand.pdbqt | data/3F/3FHE-28P/3FHE-28P_target.pdbqt | null | null |
3FZM-3GO | data/3F/3FZM-3GO/3FZM-3GO_ligand.pdbqt | data/3F/3FZM-3GO/3FZM-3GO_target.pdbqt | data/3F/3FZM-3GO/3FZM-3GO_decoys.pdbqt | data/3F/3FZM-3GO/3FZM-3GO_decoy_scores.csv |
3FPG-B3P | data/3F/3FPG-B3P/3FPG-B3P_ligand.pdbqt | data/3F/3FPG-B3P/3FPG-B3P_target.pdbqt | data/3F/3FPG-B3P/3FPG-B3P_decoys.pdbqt | data/3F/3FPG-B3P/3FPG-B3P_decoy_scores.csv |
3FTY-3IP | data/3F/3FTY-3IP/3FTY-3IP_ligand.pdbqt | data/3F/3FTY-3IP/3FTY-3IP_target.pdbqt | null | null |
3FVF-1JZ | data/3F/3FVF-1JZ/3FVF-1JZ_ligand.pdbqt | data/3F/3FVF-1JZ/3FVF-1JZ_target.pdbqt | data/3F/3FVF-1JZ/3FVF-1JZ_decoys.pdbqt | data/3F/3FVF-1JZ/3FVF-1JZ_decoy_scores.csv |
3FO7-IMN | data/3F/3FO7-IMN/3FO7-IMN_ligand.pdbqt | data/3F/3FO7-IMN/3FO7-IMN_target.pdbqt | data/3F/3FO7-IMN/3FO7-IMN_decoys.pdbqt | data/3F/3FO7-IMN/3FO7-IMN_decoy_scores.csv |
3FO2-BZH | data/3F/3FO2-BZH/3FO2-BZH_ligand.pdbqt | data/3F/3FO2-BZH/3FO2-BZH_target.pdbqt | data/3F/3FO2-BZH/3FO2-BZH_decoys.pdbqt | data/3F/3FO2-BZH/3FO2-BZH_decoy_scores.csv |
3FNA-AMP | data/3F/3FNA-AMP/3FNA-AMP_ligand.pdbqt | data/3F/3FNA-AMP/3FNA-AMP_target.pdbqt | data/3F/3FNA-AMP/3FNA-AMP_decoys.pdbqt | data/3F/3FNA-AMP/3FNA-AMP_decoy_scores.csv |
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