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 ⌀ |
|---|---|---|---|---|
5FSO-S76 | data/5F/5FSO-S76/5FSO-S76_ligand.pdbqt | data/5F/5FSO-S76/5FSO-S76_target.pdbqt | data/5F/5FSO-S76/5FSO-S76_decoys.pdbqt | data/5F/5FSO-S76/5FSO-S76_decoy_scores.csv |
5FXL-BEN | data/5F/5FXL-BEN/5FXL-BEN_ligand.pdbqt | data/5F/5FXL-BEN/5FXL-BEN_target.pdbqt | data/5F/5FXL-BEN/5FXL-BEN_decoys.pdbqt | data/5F/5FXL-BEN/5FXL-BEN_decoy_scores.csv |
5FEP-CPS | data/5F/5FEP-CPS/5FEP-CPS_ligand.pdbqt | data/5F/5FEP-CPS/5FEP-CPS_target.pdbqt | data/5F/5FEP-CPS/5FEP-CPS_decoys.pdbqt | data/5F/5FEP-CPS/5FEP-CPS_decoy_scores.csv |
5FHF-ADP | data/5F/5FHF-ADP/5FHF-ADP_ligand.pdbqt | data/5F/5FHF-ADP/5FHF-ADP_target.pdbqt | null | null |
5FDI-5WM | data/5F/5FDI-5WM/5FDI-5WM_ligand.pdbqt | data/5F/5FDI-5WM/5FDI-5WM_target.pdbqt | data/5F/5FDI-5WM/5FDI-5WM_decoys.pdbqt | data/5F/5FDI-5WM/5FDI-5WM_decoy_scores.csv |
5FU8-DH5 | data/5F/5FU8-DH5/5FU8-DH5_ligand.pdbqt | data/5F/5FU8-DH5/5FU8-DH5_target.pdbqt | data/5F/5FU8-DH5/5FU8-DH5_decoys.pdbqt | data/5F/5FU8-DH5/5FU8-DH5_decoy_scores.csv |
5F2D-THP | data/5F/5F2D-THP/5F2D-THP_ligand.pdbqt | data/5F/5F2D-THP/5F2D-THP_target.pdbqt | data/5F/5F2D-THP/5F2D-THP_decoys.pdbqt | data/5F/5F2D-THP/5F2D-THP_decoy_scores.csv |
5FWG-GPR | data/5F/5FWG-GPR/5FWG-GPR_ligand.pdbqt | data/5F/5FWG-GPR/5FWG-GPR_target.pdbqt | data/5F/5FWG-GPR/5FWG-GPR_decoys.pdbqt | data/5F/5FWG-GPR/5FWG-GPR_decoy_scores.csv |
5FC4-5WK | data/5F/5FC4-5WK/5FC4-5WK_ligand.pdbqt | data/5F/5FC4-5WK/5FC4-5WK_target.pdbqt | data/5F/5FC4-5WK/5FC4-5WK_decoys.pdbqt | data/5F/5FC4-5WK/5FC4-5WK_decoy_scores.csv |
5FP3-YC8 | data/5F/5FP3-YC8/5FP3-YC8_ligand.pdbqt | data/5F/5FP3-YC8/5FP3-YC8_target.pdbqt | data/5F/5FP3-YC8/5FP3-YC8_decoys.pdbqt | data/5F/5FP3-YC8/5FP3-YC8_decoy_scores.csv |
5FTC-ADP | data/5F/5FTC-ADP/5FTC-ADP_ligand.pdbqt | data/5F/5FTC-ADP/5FTC-ADP_target.pdbqt | data/5F/5FTC-ADP/5FTC-ADP_decoys.pdbqt | data/5F/5FTC-ADP/5FTC-ADP_decoy_scores.csv |
5F3C-5U8 | data/5F/5F3C-5U8/5F3C-5U8_ligand.pdbqt | data/5F/5F3C-5U8/5F3C-5U8_target.pdbqt | data/5F/5F3C-5U8/5F3C-5U8_decoys.pdbqt | data/5F/5F3C-5U8/5F3C-5U8_decoy_scores.csv |
5F6W-5VL | data/5F/5F6W-5VL/5F6W-5VL_ligand.pdbqt | data/5F/5F6W-5VL/5F6W-5VL_target.pdbqt | data/5F/5F6W-5VL/5F6W-5VL_decoys.pdbqt | data/5F/5F6W-5VL/5F6W-5VL_decoy_scores.csv |
5FQJ-6NT | data/5F/5FQJ-6NT/5FQJ-6NT_ligand.pdbqt | data/5F/5FQJ-6NT/5FQJ-6NT_target.pdbqt | data/5F/5FQJ-6NT/5FQJ-6NT_decoys.pdbqt | data/5F/5FQJ-6NT/5FQJ-6NT_decoy_scores.csv |
5FEZ-5AD | data/5F/5FEZ-5AD/5FEZ-5AD_ligand.pdbqt | data/5F/5FEZ-5AD/5FEZ-5AD_target.pdbqt | data/5F/5FEZ-5AD/5FEZ-5AD_decoys.pdbqt | data/5F/5FEZ-5AD/5FEZ-5AD_decoy_scores.csv |
5FFF-5XC | data/5F/5FFF-5XC/5FFF-5XC_ligand.pdbqt | data/5F/5FFF-5XC/5FFF-5XC_target.pdbqt | data/5F/5FFF-5XC/5FFF-5XC_decoys.pdbqt | data/5F/5FFF-5XC/5FFF-5XC_decoy_scores.csv |
5FWR-3X8 | data/5F/5FWR-3X8/5FWR-3X8_ligand.pdbqt | data/5F/5FWR-3X8/5FWR-3X8_target.pdbqt | data/5F/5FWR-3X8/5FWR-3X8_decoys.pdbqt | data/5F/5FWR-3X8/5FWR-3X8_decoy_scores.csv |
5FSX-ADP | data/5F/5FSX-ADP/5FSX-ADP_ligand.pdbqt | data/5F/5FSX-ADP/5FSX-ADP_target.pdbqt | data/5F/5FSX-ADP/5FSX-ADP_decoys.pdbqt | data/5F/5FSX-ADP/5FSX-ADP_decoy_scores.csv |
5FF3-CPS | data/5F/5FF3-CPS/5FF3-CPS_ligand.pdbqt | data/5F/5FF3-CPS/5FF3-CPS_target.pdbqt | data/5F/5FF3-CPS/5FF3-CPS_decoys.pdbqt | data/5F/5FF3-CPS/5FF3-CPS_decoy_scores.csv |
5F32-5V7 | data/5F/5F32-5V7/5F32-5V7_ligand.pdbqt | data/5F/5F32-5V7/5F32-5V7_target.pdbqt | data/5F/5F32-5V7/5F32-5V7_decoys.pdbqt | data/5F/5F32-5V7/5F32-5V7_decoy_scores.csv |
5F36-5UE | data/5F/5F36-5UE/5F36-5UE_ligand.pdbqt | data/5F/5F36-5UE/5F36-5UE_target.pdbqt | data/5F/5F36-5UE/5F36-5UE_decoys.pdbqt | data/5F/5F36-5UE/5F36-5UE_decoy_scores.csv |
5FHV-P6G | data/5F/5FHV-P6G/5FHV-P6G_ligand.pdbqt | data/5F/5FHV-P6G/5FHV-P6G_target.pdbqt | data/5F/5FHV-P6G/5FHV-P6G_decoys.pdbqt | data/5F/5FHV-P6G/5FHV-P6G_decoy_scores.csv |
5F0X-DAT | data/5F/5F0X-DAT/5F0X-DAT_ligand.pdbqt | data/5F/5F0X-DAT/5F0X-DAT_target.pdbqt | data/5F/5F0X-DAT/5F0X-DAT_decoys.pdbqt | data/5F/5F0X-DAT/5F0X-DAT_decoy_scores.csv |
5FXE-CIY | data/5F/5FXE-CIY/5FXE-CIY_ligand.pdbqt | data/5F/5FXE-CIY/5FXE-CIY_target.pdbqt | data/5F/5FXE-CIY/5FXE-CIY_decoys.pdbqt | data/5F/5FXE-CIY/5FXE-CIY_decoy_scores.csv |
5F3T-5UH | data/5F/5F3T-5UH/5F3T-5UH_ligand.pdbqt | data/5F/5F3T-5UH/5F3T-5UH_target.pdbqt | data/5F/5F3T-5UH/5F3T-5UH_decoys.pdbqt | data/5F/5F3T-5UH/5F3T-5UH_decoy_scores.csv |
5FZ3-7SI | data/5F/5FZ3-7SI/5FZ3-7SI_ligand.pdbqt | data/5F/5FZ3-7SI/5FZ3-7SI_target.pdbqt | data/5F/5FZ3-7SI/5FZ3-7SI_decoys.pdbqt | data/5F/5FZ3-7SI/5FZ3-7SI_decoy_scores.csv |
5F27-5TT | data/5F/5F27-5TT/5F27-5TT_ligand.pdbqt | data/5F/5F27-5TT/5F27-5TT_target.pdbqt | data/5F/5F27-5TT/5F27-5TT_decoys.pdbqt | data/5F/5F27-5TT/5F27-5TT_decoy_scores.csv |
5F0H-5TC | data/5F/5F0H-5TC/5F0H-5TC_ligand.pdbqt | data/5F/5F0H-5TC/5F0H-5TC_target.pdbqt | data/5F/5F0H-5TC/5F0H-5TC_decoys.pdbqt | data/5F/5F0H-5TC/5F0H-5TC_decoy_scores.csv |
5FTV-KDT | data/5F/5FTV-KDT/5FTV-KDT_ligand.pdbqt | data/5F/5FTV-KDT/5FTV-KDT_target.pdbqt | data/5F/5FTV-KDT/5FTV-KDT_decoys.pdbqt | data/5F/5FTV-KDT/5FTV-KDT_decoy_scores.csv |
5FE1-12Q | data/5F/5FE1-12Q/5FE1-12Q_ligand.pdbqt | data/5F/5FE1-12Q/5FE1-12Q_target.pdbqt | data/5F/5FE1-12Q/5FE1-12Q_decoys.pdbqt | data/5F/5FE1-12Q/5FE1-12Q_decoy_scores.csv |
5F2O-SAH | data/5F/5F2O-SAH/5F2O-SAH_ligand.pdbqt | data/5F/5F2O-SAH/5F2O-SAH_target.pdbqt | data/5F/5F2O-SAH/5F2O-SAH_decoys.pdbqt | data/5F/5F2O-SAH/5F2O-SAH_decoy_scores.csv |
5FBO-5WH | data/5F/5FBO-5WH/5FBO-5WH_ligand.pdbqt | data/5F/5FBO-5WH/5FBO-5WH_target.pdbqt | data/5F/5FBO-5WH/5FBO-5WH_decoys.pdbqt | data/5F/5FBO-5WH/5FBO-5WH_decoy_scores.csv |
5FBX-5W4 | data/5F/5FBX-5W4/5FBX-5W4_ligand.pdbqt | data/5F/5FBX-5W4/5FBX-5W4_target.pdbqt | data/5F/5FBX-5W4/5FBX-5W4_decoys.pdbqt | data/5F/5FBX-5W4/5FBX-5W4_decoy_scores.csv |
5FNF-TQL | data/5F/5FNF-TQL/5FNF-TQL_ligand.pdbqt | data/5F/5FNF-TQL/5FNF-TQL_target.pdbqt | data/5F/5FNF-TQL/5FNF-TQL_decoys.pdbqt | data/5F/5FNF-TQL/5FNF-TQL_decoy_scores.csv |
5FUW-QBT | data/5F/5FUW-QBT/5FUW-QBT_ligand.pdbqt | data/5F/5FUW-QBT/5FUW-QBT_target.pdbqt | data/5F/5FUW-QBT/5FUW-QBT_decoys.pdbqt | data/5F/5FUW-QBT/5FUW-QBT_decoy_scores.csv |
5FPO-10L | data/5F/5FPO-10L/5FPO-10L_ligand.pdbqt | data/5F/5FPO-10L/5FPO-10L_target.pdbqt | data/5F/5FPO-10L/5FPO-10L_decoys.pdbqt | data/5F/5FPO-10L/5FPO-10L_decoy_scores.csv |
5FL1-DV1 | data/5F/5FL1-DV1/5FL1-DV1_ligand.pdbqt | data/5F/5FL1-DV1/5FL1-DV1_target.pdbqt | data/5F/5FL1-DV1/5FL1-DV1_decoys.pdbqt | data/5F/5FL1-DV1/5FL1-DV1_decoy_scores.csv |
5FFY-5XD | data/5F/5FFY-5XD/5FFY-5XD_ligand.pdbqt | data/5F/5FFY-5XD/5FFY-5XD_target.pdbqt | data/5F/5FFY-5XD/5FFY-5XD_decoys.pdbqt | data/5F/5FFY-5XD/5FFY-5XD_decoy_scores.csv |
5FGK-5XG | data/5F/5FGK-5XG/5FGK-5XG_ligand.pdbqt | data/5F/5FGK-5XG/5FGK-5XG_target.pdbqt | data/5F/5FGK-5XG/5FGK-5XG_decoys.pdbqt | data/5F/5FGK-5XG/5FGK-5XG_decoy_scores.csv |
5FND-IQ5 | data/5F/5FND-IQ5/5FND-IQ5_ligand.pdbqt | data/5F/5FND-IQ5/5FND-IQ5_target.pdbqt | data/5F/5FND-IQ5/5FND-IQ5_decoys.pdbqt | data/5F/5FND-IQ5/5FND-IQ5_decoy_scores.csv |
5FG3-GDP | data/5F/5FG3-GDP/5FG3-GDP_ligand.pdbqt | data/5F/5FG3-GDP/5FG3-GDP_target.pdbqt | data/5F/5FG3-GDP/5FG3-GDP_decoys.pdbqt | data/5F/5FG3-GDP/5FG3-GDP_decoy_scores.csv |
5FPL-QAY | data/5F/5FPL-QAY/5FPL-QAY_ligand.pdbqt | data/5F/5FPL-QAY/5FPL-QAY_target.pdbqt | data/5F/5FPL-QAY/5FPL-QAY_decoys.pdbqt | data/5F/5FPL-QAY/5FPL-QAY_decoy_scores.csv |
5F2F-5U7 | data/5F/5F2F-5U7/5F2F-5U7_ligand.pdbqt | data/5F/5F2F-5U7/5F2F-5U7_target.pdbqt | data/5F/5F2F-5U7/5F2F-5U7_decoys.pdbqt | data/5F/5F2F-5U7/5F2F-5U7_decoy_scores.csv |
5FBO-5WE | data/5F/5FBO-5WE/5FBO-5WE_ligand.pdbqt | data/5F/5FBO-5WE/5FBO-5WE_target.pdbqt | data/5F/5FBO-5WE/5FBO-5WE_decoys.pdbqt | data/5F/5FBO-5WE/5FBO-5WE_decoy_scores.csv |
5FRC-AZA | data/5F/5FRC-AZA/5FRC-AZA_ligand.pdbqt | data/5F/5FRC-AZA/5FRC-AZA_target.pdbqt | data/5F/5FRC-AZA/5FRC-AZA_decoys.pdbqt | data/5F/5FRC-AZA/5FRC-AZA_decoy_scores.csv |
5FZI-FIG | data/5F/5FZI-FIG/5FZI-FIG_ligand.pdbqt | data/5F/5FZI-FIG/5FZI-FIG_target.pdbqt | data/5F/5FZI-FIG/5FZI-FIG_decoys.pdbqt | data/5F/5FZI-FIG/5FZI-FIG_decoy_scores.csv |
5FVW-W66 | data/5F/5FVW-W66/5FVW-W66_ligand.pdbqt | data/5F/5FVW-W66/5FVW-W66_target.pdbqt | data/5F/5FVW-W66/5FVW-W66_decoys.pdbqt | data/5F/5FVW-W66/5FVW-W66_decoy_scores.csv |
5FQ0-FLC | data/5F/5FQ0-FLC/5FQ0-FLC_ligand.pdbqt | data/5F/5FQ0-FLC/5FQ0-FLC_target.pdbqt | data/5F/5FQ0-FLC/5FQ0-FLC_decoys.pdbqt | data/5F/5FQ0-FLC/5FQ0-FLC_decoy_scores.csv |
5FE6-5WZ | data/5F/5FE6-5WZ/5FE6-5WZ_ligand.pdbqt | data/5F/5FE6-5WZ/5FE6-5WZ_target.pdbqt | data/5F/5FE6-5WZ/5FE6-5WZ_decoys.pdbqt | data/5F/5FE6-5WZ/5FE6-5WZ_decoy_scores.csv |
5FCW-5YA | data/5F/5FCW-5YA/5FCW-5YA_ligand.pdbqt | data/5F/5FCW-5YA/5FCW-5YA_target.pdbqt | data/5F/5FCW-5YA/5FCW-5YA_decoys.pdbqt | data/5F/5FCW-5YA/5FCW-5YA_decoy_scores.csv |
5F3M-NEU | data/5F/5F3M-NEU/5F3M-NEU_ligand.pdbqt | data/5F/5F3M-NEU/5F3M-NEU_target.pdbqt | data/5F/5F3M-NEU/5F3M-NEU_decoys.pdbqt | data/5F/5F3M-NEU/5F3M-NEU_decoy_scores.csv |
5FF2-SAH | data/5F/5FF2-SAH/5FF2-SAH_ligand.pdbqt | data/5F/5FF2-SAH/5FF2-SAH_target.pdbqt | data/5F/5FF2-SAH/5FF2-SAH_decoys.pdbqt | data/5F/5FF2-SAH/5FF2-SAH_decoy_scores.csv |
5FAN-DHB | data/5F/5FAN-DHB/5FAN-DHB_ligand.pdbqt | data/5F/5FAN-DHB/5FAN-DHB_target.pdbqt | data/5F/5FAN-DHB/5FAN-DHB_decoys.pdbqt | data/5F/5FAN-DHB/5FAN-DHB_decoy_scores.csv |
5FTS-P3I | data/5F/5FTS-P3I/5FTS-P3I_ligand.pdbqt | data/5F/5FTS-P3I/5FTS-P3I_target.pdbqt | data/5F/5FTS-P3I/5FTS-P3I_decoys.pdbqt | data/5F/5FTS-P3I/5FTS-P3I_decoy_scores.csv |
5FLL-WAQ | data/5F/5FLL-WAQ/5FLL-WAQ_ligand.pdbqt | data/5F/5FLL-WAQ/5FLL-WAQ_target.pdbqt | data/5F/5FLL-WAQ/5FLL-WAQ_decoys.pdbqt | data/5F/5FLL-WAQ/5FLL-WAQ_decoy_scores.csv |
5F2G-P6F | data/5F/5F2G-P6F/5F2G-P6F_ligand.pdbqt | data/5F/5F2G-P6F/5F2G-P6F_target.pdbqt | data/5F/5F2G-P6F/5F2G-P6F_decoys.pdbqt | data/5F/5F2G-P6F/5F2G-P6F_decoy_scores.csv |
5FZF-UUN | data/5F/5FZF-UUN/5FZF-UUN_ligand.pdbqt | data/5F/5FZF-UUN/5FZF-UUN_target.pdbqt | data/5F/5FZF-UUN/5FZF-UUN_decoys.pdbqt | data/5F/5FZF-UUN/5FZF-UUN_decoy_scores.csv |
5FZ1-W77 | data/5F/5FZ1-W77/5FZ1-W77_ligand.pdbqt | data/5F/5FZ1-W77/5FZ1-W77_target.pdbqt | data/5F/5FZ1-W77/5FZ1-W77_decoys.pdbqt | data/5F/5FZ1-W77/5FZ1-W77_decoy_scores.csv |
5FF4-SAH | data/5F/5FF4-SAH/5FF4-SAH_ligand.pdbqt | data/5F/5FF4-SAH/5FF4-SAH_target.pdbqt | data/5F/5FF4-SAH/5FF4-SAH_decoys.pdbqt | data/5F/5FF4-SAH/5FF4-SAH_decoy_scores.csv |
5F1Q-GLN | data/5F/5F1Q-GLN/5F1Q-GLN_ligand.pdbqt | data/5F/5F1Q-GLN/5F1Q-GLN_target.pdbqt | data/5F/5F1Q-GLN/5F1Q-GLN_decoys.pdbqt | data/5F/5F1Q-GLN/5F1Q-GLN_decoy_scores.csv |
5FWA-J7C | data/5F/5FWA-J7C/5FWA-J7C_ligand.pdbqt | data/5F/5FWA-J7C/5FWA-J7C_target.pdbqt | data/5F/5FWA-J7C/5FWA-J7C_decoys.pdbqt | data/5F/5FWA-J7C/5FWA-J7C_decoy_scores.csv |
5FLI-QUE | data/5F/5FLI-QUE/5FLI-QUE_ligand.pdbqt | data/5F/5FLI-QUE/5FLI-QUE_target.pdbqt | data/5F/5FLI-QUE/5FLI-QUE_decoys.pdbqt | data/5F/5FLI-QUE/5FLI-QUE_decoy_scores.csv |
5FYR-INS | data/5F/5FYR-INS/5FYR-INS_ligand.pdbqt | data/5F/5FYR-INS/5FYR-INS_target.pdbqt | data/5F/5FYR-INS/5FYR-INS_decoys.pdbqt | data/5F/5FYR-INS/5FYR-INS_decoy_scores.csv |
5FAL-SKT | data/5F/5FAL-SKT/5FAL-SKT_ligand.pdbqt | data/5F/5FAL-SKT/5FAL-SKT_target.pdbqt | data/5F/5FAL-SKT/5FAL-SKT_decoys.pdbqt | data/5F/5FAL-SKT/5FAL-SKT_decoy_scores.csv |
5FNL-5ON | data/5F/5FNL-5ON/5FNL-5ON_ligand.pdbqt | data/5F/5FNL-5ON/5FNL-5ON_target.pdbqt | data/5F/5FNL-5ON/5FNL-5ON_decoys.pdbqt | data/5F/5FNL-5ON/5FNL-5ON_decoy_scores.csv |
5FJR-NPQ | data/5F/5FJR-NPQ/5FJR-NPQ_ligand.pdbqt | data/5F/5FJR-NPQ/5FJR-NPQ_target.pdbqt | data/5F/5FJR-NPQ/5FJR-NPQ_decoys.pdbqt | data/5F/5FJR-NPQ/5FJR-NPQ_decoy_scores.csv |
5FBP-F6P | data/5F/5FBP-F6P/5FBP-F6P_ligand.pdbqt | data/5F/5FBP-F6P/5FBP-F6P_target.pdbqt | data/5F/5FBP-F6P/5FBP-F6P_decoys.pdbqt | data/5F/5FBP-F6P/5FBP-F6P_decoy_scores.csv |
5FH2-GTP | data/5F/5FH2-GTP/5FH2-GTP_ligand.pdbqt | data/5F/5FH2-GTP/5FH2-GTP_target.pdbqt | data/5F/5FH2-GTP/5FH2-GTP_decoys.pdbqt | data/5F/5FH2-GTP/5FH2-GTP_decoy_scores.csv |
5FIT-AP2 | data/5F/5FIT-AP2/5FIT-AP2_ligand.pdbqt | data/5F/5FIT-AP2/5FIT-AP2_target.pdbqt | data/5F/5FIT-AP2/5FIT-AP2_decoys.pdbqt | data/5F/5FIT-AP2/5FIT-AP2_decoy_scores.csv |
5FXQ-GD5 | data/5F/5FXQ-GD5/5FXQ-GD5_ligand.pdbqt | data/5F/5FXQ-GD5/5FXQ-GD5_target.pdbqt | data/5F/5FXQ-GD5/5FXQ-GD5_decoys.pdbqt | data/5F/5FXQ-GD5/5FXQ-GD5_decoy_scores.csv |
5FH8-5XK | data/5F/5FH8-5XK/5FH8-5XK_ligand.pdbqt | data/5F/5FH8-5XK/5FH8-5XK_target.pdbqt | data/5F/5FH8-5XK/5FH8-5XK_decoys.pdbqt | data/5F/5FH8-5XK/5FH8-5XK_decoy_scores.csv |
5FL6-Y0R | data/5F/5FL6-Y0R/5FL6-Y0R_ligand.pdbqt | data/5F/5FL6-Y0R/5FL6-Y0R_target.pdbqt | data/5F/5FL6-Y0R/5FL6-Y0R_decoys.pdbqt | data/5F/5FL6-Y0R/5FL6-Y0R_decoy_scores.csv |
5FPP-HI6 | data/5F/5FPP-HI6/5FPP-HI6_ligand.pdbqt | data/5F/5FPP-HI6/5FPP-HI6_target.pdbqt | data/5F/5FPP-HI6/5FPP-HI6_decoys.pdbqt | data/5F/5FPP-HI6/5FPP-HI6_decoy_scores.csv |
5FFH-RET | data/5F/5FFH-RET/5FFH-RET_ligand.pdbqt | data/5F/5FFH-RET/5FFH-RET_target.pdbqt | data/5F/5FFH-RET/5FFH-RET_decoys.pdbqt | data/5F/5FFH-RET/5FFH-RET_decoy_scores.csv |
5FH4-GTP | data/5F/5FH4-GTP/5FH4-GTP_ligand.pdbqt | data/5F/5FH4-GTP/5FH4-GTP_target.pdbqt | data/5F/5FH4-GTP/5FH4-GTP_decoys.pdbqt | data/5F/5FH4-GTP/5FH4-GTP_decoy_scores.csv |
5FHQ-DNC | data/5F/5FHQ-DNC/5FHQ-DNC_ligand.pdbqt | data/5F/5FHQ-DNC/5FHQ-DNC_target.pdbqt | data/5F/5FHQ-DNC/5FHQ-DNC_decoys.pdbqt | data/5F/5FHQ-DNC/5FHQ-DNC_decoy_scores.csv |
5F4N-5UY | data/5F/5F4N-5UY/5F4N-5UY_ligand.pdbqt | data/5F/5F4N-5UY/5F4N-5UY_target.pdbqt | data/5F/5F4N-5UY/5F4N-5UY_decoys.pdbqt | data/5F/5F4N-5UY/5F4N-5UY_decoy_scores.csv |
5F9T-SFJ | data/5F/5F9T-SFJ/5F9T-SFJ_ligand.pdbqt | data/5F/5F9T-SFJ/5F9T-SFJ_target.pdbqt | data/5F/5F9T-SFJ/5F9T-SFJ_decoys.pdbqt | data/5F/5F9T-SFJ/5F9T-SFJ_decoy_scores.csv |
5FAI-SAH | data/5F/5FAI-SAH/5FAI-SAH_ligand.pdbqt | data/5F/5FAI-SAH/5FAI-SAH_target.pdbqt | data/5F/5FAI-SAH/5FAI-SAH_decoys.pdbqt | data/5F/5FAI-SAH/5FAI-SAH_decoy_scores.csv |
5FVR-H4B | data/5F/5FVR-H4B/5FVR-H4B_ligand.pdbqt | data/5F/5FVR-H4B/5FVR-H4B_target.pdbqt | data/5F/5FVR-H4B/5FVR-H4B_decoys.pdbqt | data/5F/5FVR-H4B/5FVR-H4B_decoy_scores.csv |
5F6L-SAH | data/5F/5F6L-SAH/5F6L-SAH_ligand.pdbqt | data/5F/5F6L-SAH/5F6L-SAH_target.pdbqt | data/5F/5F6L-SAH/5F6L-SAH_decoys.pdbqt | data/5F/5F6L-SAH/5F6L-SAH_decoy_scores.csv |
5F24-IPD | data/5F/5F24-IPD/5F24-IPD_ligand.pdbqt | data/5F/5F24-IPD/5F24-IPD_target.pdbqt | data/5F/5F24-IPD/5F24-IPD_decoys.pdbqt | data/5F/5F24-IPD/5F24-IPD_decoy_scores.csv |
5F6Y-5VM | data/5F/5F6Y-5VM/5F6Y-5VM_ligand.pdbqt | data/5F/5F6Y-5VM/5F6Y-5VM_target.pdbqt | data/5F/5F6Y-5VM/5F6Y-5VM_decoys.pdbqt | data/5F/5F6Y-5VM/5F6Y-5VM_decoy_scores.csv |
5FZG-7IA | data/5F/5FZG-7IA/5FZG-7IA_ligand.pdbqt | data/5F/5FZG-7IA/5FZG-7IA_target.pdbqt | data/5F/5FZG-7IA/5FZG-7IA_decoys.pdbqt | data/5F/5FZG-7IA/5FZG-7IA_decoy_scores.csv |
5F1G-AMP | data/5F/5F1G-AMP/5F1G-AMP_ligand.pdbqt | data/5F/5F1G-AMP/5F1G-AMP_target.pdbqt | data/5F/5F1G-AMP/5F1G-AMP_decoys.pdbqt | data/5F/5F1G-AMP/5F1G-AMP_decoy_scores.csv |
5F77-ADE | data/5F/5F77-ADE/5F77-ADE_ligand.pdbqt | data/5F/5F77-ADE/5F77-ADE_target.pdbqt | data/5F/5F77-ADE/5F77-ADE_decoys.pdbqt | data/5F/5F77-ADE/5F77-ADE_decoy_scores.csv |
5FG4-5XE | data/5F/5FG4-5XE/5FG4-5XE_ligand.pdbqt | data/5F/5FG4-5XE/5FG4-5XE_target.pdbqt | data/5F/5FG4-5XE/5FG4-5XE_decoys.pdbqt | data/5F/5FG4-5XE/5FG4-5XE_decoy_scores.csv |
5FVB-PEB | data/5F/5FVB-PEB/5FVB-PEB_ligand.pdbqt | data/5F/5FVB-PEB/5FVB-PEB_target.pdbqt | data/5F/5FVB-PEB/5FVB-PEB_decoys.pdbqt | data/5F/5FVB-PEB/5FVB-PEB_decoy_scores.csv |
5F05-12P | data/5F/5F05-12P/5F05-12P_ligand.pdbqt | data/5F/5F05-12P/5F05-12P_target.pdbqt | data/5F/5F05-12P/5F05-12P_decoys.pdbqt | data/5F/5F05-12P/5F05-12P_decoy_scores.csv |
5FQT-7QN | data/5F/5FQT-7QN/5FQT-7QN_ligand.pdbqt | data/5F/5FQT-7QN/5FQT-7QN_target.pdbqt | data/5F/5FQT-7QN/5FQT-7QN_decoys.pdbqt | data/5F/5FQT-7QN/5FQT-7QN_decoy_scores.csv |
5FBI-5WD | data/5F/5FBI-5WD/5FBI-5WD_ligand.pdbqt | data/5F/5FBI-5WD/5FBI-5WD_target.pdbqt | data/5F/5FBI-5WD/5FBI-5WD_decoys.pdbqt | data/5F/5FBI-5WD/5FBI-5WD_decoy_scores.csv |
5FP6-MFZ | data/5F/5FP6-MFZ/5FP6-MFZ_ligand.pdbqt | data/5F/5FP6-MFZ/5FP6-MFZ_target.pdbqt | data/5F/5FP6-MFZ/5FP6-MFZ_decoys.pdbqt | data/5F/5FP6-MFZ/5FP6-MFZ_decoy_scores.csv |
5F1U-3VN | data/5F/5F1U-3VN/5F1U-3VN_ligand.pdbqt | data/5F/5F1U-3VN/5F1U-3VN_target.pdbqt | data/5F/5F1U-3VN/5F1U-3VN_decoys.pdbqt | data/5F/5F1U-3VN/5F1U-3VN_decoy_scores.csv |
5FQD-LVY | data/5F/5FQD-LVY/5FQD-LVY_ligand.pdbqt | data/5F/5FQD-LVY/5FQD-LVY_target.pdbqt | data/5F/5FQD-LVY/5FQD-LVY_decoys.pdbqt | data/5F/5FQD-LVY/5FQD-LVY_decoy_scores.csv |
5F8Y-X6X | data/5F/5F8Y-X6X/5F8Y-X6X_ligand.pdbqt | data/5F/5F8Y-X6X/5F8Y-X6X_target.pdbqt | data/5F/5F8Y-X6X/5F8Y-X6X_decoys.pdbqt | data/5F/5F8Y-X6X/5F8Y-X6X_decoy_scores.csv |
5F4B-FMN | data/5F/5F4B-FMN/5F4B-FMN_ligand.pdbqt | data/5F/5F4B-FMN/5F4B-FMN_target.pdbqt | data/5F/5F4B-FMN/5F4B-FMN_decoys.pdbqt | data/5F/5F4B-FMN/5F4B-FMN_decoy_scores.csv |
5FJK-EM6 | data/5F/5FJK-EM6/5FJK-EM6_ligand.pdbqt | data/5F/5FJK-EM6/5FJK-EM6_target.pdbqt | data/5F/5FJK-EM6/5FJK-EM6_decoys.pdbqt | data/5F/5FJK-EM6/5FJK-EM6_decoy_scores.csv |
5FJN-BE2 | data/5F/5FJN-BE2/5FJN-BE2_ligand.pdbqt | data/5F/5FJN-BE2/5FJN-BE2_target.pdbqt | data/5F/5FJN-BE2/5FJN-BE2_decoys.pdbqt | data/5F/5FJN-BE2/5FJN-BE2_decoy_scores.csv |
5FI8-FMN | data/5F/5FI8-FMN/5FI8-FMN_ligand.pdbqt | data/5F/5FI8-FMN/5FI8-FMN_target.pdbqt | data/5F/5FI8-FMN/5FI8-FMN_decoys.pdbqt | data/5F/5FI8-FMN/5FI8-FMN_decoy_scores.csv |
5FBN-5WF | data/5F/5FBN-5WF/5FBN-5WF_ligand.pdbqt | data/5F/5FBN-5WF/5FBN-5WF_target.pdbqt | data/5F/5FBN-5WF/5FBN-5WF_decoys.pdbqt | data/5F/5FBN-5WF/5FBN-5WF_decoy_scores.csv |
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