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 ⌀ |
|---|---|---|---|---|
3POT-TP7 | data/3P/3POT-TP7/3POT-TP7_ligand.pdbqt | data/3P/3POT-TP7/3POT-TP7_target.pdbqt | data/3P/3POT-TP7/3POT-TP7_decoys.pdbqt | data/3P/3POT-TP7/3POT-TP7_decoy_scores.csv |
3PY1-2AN | data/3P/3PY1-2AN/3PY1-2AN_ligand.pdbqt | data/3P/3PY1-2AN/3PY1-2AN_target.pdbqt | data/3P/3PY1-2AN/3PY1-2AN_decoys.pdbqt | data/3P/3PY1-2AN/3PY1-2AN_decoy_scores.csv |
3PG3-DG7 | data/3P/3PG3-DG7/3PG3-DG7_ligand.pdbqt | data/3P/3PG3-DG7/3PG3-DG7_target.pdbqt | data/3P/3PG3-DG7/3PG3-DG7_decoys.pdbqt | data/3P/3PG3-DG7/3PG3-DG7_decoy_scores.csv |
3PJF-TCL | data/3P/3PJF-TCL/3PJF-TCL_ligand.pdbqt | data/3P/3PJF-TCL/3PJF-TCL_target.pdbqt | data/3P/3PJF-TCL/3PJF-TCL_decoys.pdbqt | data/3P/3PJF-TCL/3PJF-TCL_decoy_scores.csv |
3PGK-ATP | data/3P/3PGK-ATP/3PGK-ATP_ligand.pdbqt | data/3P/3PGK-ATP/3PGK-ATP_target.pdbqt | data/3P/3PGK-ATP/3PGK-ATP_decoys.pdbqt | data/3P/3PGK-ATP/3PGK-ATP_decoy_scores.csv |
3P10-CTN | data/3P/3P10-CTN/3P10-CTN_ligand.pdbqt | data/3P/3P10-CTN/3P10-CTN_target.pdbqt | data/3P/3P10-CTN/3P10-CTN_decoys.pdbqt | data/3P/3P10-CTN/3P10-CTN_decoy_scores.csv |
3PB7-PBD | data/3P/3PB7-PBD/3PB7-PBD_ligand.pdbqt | data/3P/3PB7-PBD/3PB7-PBD_target.pdbqt | data/3P/3PB7-PBD/3PB7-PBD_decoys.pdbqt | data/3P/3PB7-PBD/3PB7-PBD_decoy_scores.csv |
3P41-DMA | data/3P/3P41-DMA/3P41-DMA_ligand.pdbqt | data/3P/3P41-DMA/3P41-DMA_target.pdbqt | data/3P/3P41-DMA/3P41-DMA_decoys.pdbqt | data/3P/3P41-DMA/3P41-DMA_decoy_scores.csv |
3P97-SAM | data/3P/3P97-SAM/3P97-SAM_ligand.pdbqt | data/3P/3P97-SAM/3P97-SAM_target.pdbqt | data/3P/3P97-SAM/3P97-SAM_decoys.pdbqt | data/3P/3P97-SAM/3P97-SAM_decoy_scores.csv |
3P5Z-BMP | data/3P/3P5Z-BMP/3P5Z-BMP_ligand.pdbqt | data/3P/3P5Z-BMP/3P5Z-BMP_target.pdbqt | data/3P/3P5Z-BMP/3P5Z-BMP_decoys.pdbqt | data/3P/3P5Z-BMP/3P5Z-BMP_decoy_scores.csv |
3PPM-1DO | data/3P/3PPM-1DO/3PPM-1DO_ligand.pdbqt | data/3P/3PPM-1DO/3PPM-1DO_target.pdbqt | data/3P/3PPM-1DO/3PPM-1DO_decoys.pdbqt | data/3P/3PPM-1DO/3PPM-1DO_decoy_scores.csv |
3PCH-CHB | data/3P/3PCH-CHB/3PCH-CHB_ligand.pdbqt | data/3P/3PCH-CHB/3PCH-CHB_target.pdbqt | data/3P/3PCH-CHB/3PCH-CHB_decoys.pdbqt | data/3P/3PCH-CHB/3PCH-CHB_decoy_scores.csv |
3PMW-GLU | data/3P/3PMW-GLU/3PMW-GLU_ligand.pdbqt | data/3P/3PMW-GLU/3PMW-GLU_target.pdbqt | data/3P/3PMW-GLU/3PMW-GLU_decoys.pdbqt | data/3P/3PMW-GLU/3PMW-GLU_decoy_scores.csv |
3P6X-C3Q | data/3P/3P6X-C3Q/3P6X-C3Q_ligand.pdbqt | data/3P/3P6X-C3Q/3P6X-C3Q_target.pdbqt | data/3P/3P6X-C3Q/3P6X-C3Q_decoys.pdbqt | data/3P/3P6X-C3Q/3P6X-C3Q_decoy_scores.csv |
3PDE-DMA | data/3P/3PDE-DMA/3PDE-DMA_ligand.pdbqt | data/3P/3PDE-DMA/3PDE-DMA_target.pdbqt | data/3P/3PDE-DMA/3PDE-DMA_decoys.pdbqt | data/3P/3PDE-DMA/3PDE-DMA_decoy_scores.csv |
3PN4-BB2 | data/3P/3PN4-BB2/3PN4-BB2_ligand.pdbqt | data/3P/3PN4-BB2/3PN4-BB2_target.pdbqt | data/3P/3PN4-BB2/3PN4-BB2_decoys.pdbqt | data/3P/3PN4-BB2/3PN4-BB2_decoy_scores.csv |
3P58-P58 | data/3P/3P58-P58/3P58-P58_ligand.pdbqt | data/3P/3P58-P58/3P58-P58_target.pdbqt | data/3P/3P58-P58/3P58-P58_decoys.pdbqt | data/3P/3P58-P58/3P58-P58_decoy_scores.csv |
3PP7-PTK | data/3P/3PP7-PTK/3PP7-PTK_ligand.pdbqt | data/3P/3PP7-PTK/3PP7-PTK_target.pdbqt | data/3P/3PP7-PTK/3PP7-PTK_decoys.pdbqt | data/3P/3PP7-PTK/3PP7-PTK_decoy_scores.csv |
3PYA-AG8 | data/3P/3PYA-AG8/3PYA-AG8_ligand.pdbqt | data/3P/3PYA-AG8/3PYA-AG8_target.pdbqt | data/3P/3PYA-AG8/3PYA-AG8_decoys.pdbqt | data/3P/3PYA-AG8/3PYA-AG8_decoy_scores.csv |
3PIJ-FRU | data/3P/3PIJ-FRU/3PIJ-FRU_ligand.pdbqt | data/3P/3PIJ-FRU/3PIJ-FRU_target.pdbqt | data/3P/3PIJ-FRU/3PIJ-FRU_decoys.pdbqt | data/3P/3PIJ-FRU/3PIJ-FRU_decoy_scores.csv |
3PM3-TFN | data/3P/3PM3-TFN/3PM3-TFN_ligand.pdbqt | data/3P/3PM3-TFN/3PM3-TFN_target.pdbqt | data/3P/3PM3-TFN/3PM3-TFN_decoys.pdbqt | data/3P/3PM3-TFN/3PM3-TFN_decoy_scores.csv |
3PUL-LYS | data/3P/3PUL-LYS/3PUL-LYS_ligand.pdbqt | data/3P/3PUL-LYS/3PUL-LYS_target.pdbqt | data/3P/3PUL-LYS/3PUL-LYS_decoys.pdbqt | data/3P/3PUL-LYS/3PUL-LYS_decoy_scores.csv |
3PBA-ZXG | data/3P/3PBA-ZXG/3PBA-ZXG_ligand.pdbqt | data/3P/3PBA-ZXG/3PBA-ZXG_target.pdbqt | data/3P/3PBA-ZXG/3PBA-ZXG_decoys.pdbqt | data/3P/3PBA-ZXG/3PBA-ZXG_decoy_scores.csv |
3PZ4-3PZ | data/3P/3PZ4-3PZ/3PZ4-3PZ_ligand.pdbqt | data/3P/3PZ4-3PZ/3PZ4-3PZ_target.pdbqt | data/3P/3PZ4-3PZ/3PZ4-3PZ_decoys.pdbqt | data/3P/3PZ4-3PZ/3PZ4-3PZ_decoy_scores.csv |
3PBZ-F02 | data/3P/3PBZ-F02/3PBZ-F02_ligand.pdbqt | data/3P/3PBZ-F02/3PBZ-F02_target.pdbqt | data/3P/3PBZ-F02/3PBZ-F02_decoys.pdbqt | data/3P/3PBZ-F02/3PBZ-F02_decoy_scores.csv |
3POQ-OLC | data/3P/3POQ-OLC/3POQ-OLC_ligand.pdbqt | data/3P/3POQ-OLC/3POQ-OLC_target.pdbqt | data/3P/3POQ-OLC/3POQ-OLC_decoys.pdbqt | data/3P/3POQ-OLC/3POQ-OLC_decoy_scores.csv |
3POX-OLC | data/3P/3POX-OLC/3POX-OLC_ligand.pdbqt | data/3P/3POX-OLC/3POX-OLC_target.pdbqt | data/3P/3POX-OLC/3POX-OLC_decoys.pdbqt | data/3P/3POX-OLC/3POX-OLC_decoy_scores.csv |
3PKL-AZA | data/3P/3PKL-AZA/3PKL-AZA_ligand.pdbqt | data/3P/3PKL-AZA/3PKL-AZA_target.pdbqt | null | null |
3PTZ-NAD | data/3P/3PTZ-NAD/3PTZ-NAD_ligand.pdbqt | data/3P/3PTZ-NAD/3PTZ-NAD_target.pdbqt | data/3P/3PTZ-NAD/3PTZ-NAD_decoys.pdbqt | data/3P/3PTZ-NAD/3PTZ-NAD_decoy_scores.csv |
3P6O-ETG | data/3P/3P6O-ETG/3P6O-ETG_ligand.pdbqt | data/3P/3P6O-ETG/3P6O-ETG_target.pdbqt | data/3P/3P6O-ETG/3P6O-ETG_decoys.pdbqt | data/3P/3P6O-ETG/3P6O-ETG_decoy_scores.csv |
3PZC-GAP | data/3P/3PZC-GAP/3PZC-GAP_ligand.pdbqt | data/3P/3PZC-GAP/3PZC-GAP_target.pdbqt | data/3P/3PZC-GAP/3PZC-GAP_decoys.pdbqt | data/3P/3PZC-GAP/3PZC-GAP_decoy_scores.csv |
3PE1-3NG | data/3P/3PE1-3NG/3PE1-3NG_ligand.pdbqt | data/3P/3PE1-3NG/3PE1-3NG_target.pdbqt | data/3P/3PE1-3NG/3PE1-3NG_decoys.pdbqt | data/3P/3PE1-3NG/3PE1-3NG_decoy_scores.csv |
3PLJ-AZA | data/3P/3PLJ-AZA/3PLJ-AZA_ligand.pdbqt | data/3P/3PLJ-AZA/3PLJ-AZA_target.pdbqt | null | null |
3PR0-JG2 | data/3P/3PR0-JG2/3PR0-JG2_ligand.pdbqt | data/3P/3PR0-JG2/3PR0-JG2_target.pdbqt | data/3P/3PR0-JG2/3PR0-JG2_decoys.pdbqt | data/3P/3PR0-JG2/3PR0-JG2_decoy_scores.csv |
3P0P-NNF | data/3P/3P0P-NNF/3P0P-NNF_ligand.pdbqt | data/3P/3P0P-NNF/3P0P-NNF_target.pdbqt | data/3P/3P0P-NNF/3P0P-NNF_decoys.pdbqt | data/3P/3P0P-NNF/3P0P-NNF_decoy_scores.csv |
3P9I-SNY | data/3P/3P9I-SNY/3P9I-SNY_ligand.pdbqt | data/3P/3P9I-SNY/3P9I-SNY_target.pdbqt | data/3P/3P9I-SNY/3P9I-SNY_decoys.pdbqt | data/3P/3P9I-SNY/3P9I-SNY_decoy_scores.csv |
3PWI-GLR | data/3P/3PWI-GLR/3PWI-GLR_ligand.pdbqt | data/3P/3PWI-GLR/3PWI-GLR_target.pdbqt | data/3P/3PWI-GLR/3PWI-GLR_decoys.pdbqt | data/3P/3PWI-GLR/3PWI-GLR_decoy_scores.csv |
3PZ2-3PZ | data/3P/3PZ2-3PZ/3PZ2-3PZ_ligand.pdbqt | data/3P/3PZ2-3PZ/3PZ2-3PZ_target.pdbqt | data/3P/3PZ2-3PZ/3PZ2-3PZ_decoys.pdbqt | data/3P/3PZ2-3PZ/3PZ2-3PZ_decoy_scores.csv |
3PTQ-NFG | data/3P/3PTQ-NFG/3PTQ-NFG_ligand.pdbqt | data/3P/3PTQ-NFG/3PTQ-NFG_target.pdbqt | data/3P/3PTQ-NFG/3PTQ-NFG_decoys.pdbqt | data/3P/3PTQ-NFG/3PTQ-NFG_decoy_scores.csv |
3PFH-SAH | data/3P/3PFH-SAH/3PFH-SAH_ligand.pdbqt | data/3P/3PFH-SAH/3PFH-SAH_target.pdbqt | data/3P/3PFH-SAH/3PFH-SAH_decoys.pdbqt | data/3P/3PFH-SAH/3PFH-SAH_decoy_scores.csv |
3PWM-017 | data/3P/3PWM-017/3PWM-017_ligand.pdbqt | data/3P/3PWM-017/3PWM-017_target.pdbqt | data/3P/3PWM-017/3PWM-017_decoys.pdbqt | data/3P/3PWM-017/3PWM-017_decoy_scores.csv |
3PWD-CZ0 | data/3P/3PWD-CZ0/3PWD-CZ0_ligand.pdbqt | data/3P/3PWD-CZ0/3PWD-CZ0_target.pdbqt | data/3P/3PWD-CZ0/3PWD-CZ0_decoys.pdbqt | data/3P/3PWD-CZ0/3PWD-CZ0_decoy_scores.csv |
3PDJ-3PJ | data/3P/3PDJ-3PJ/3PDJ-3PJ_ligand.pdbqt | data/3P/3PDJ-3PJ/3PDJ-3PJ_target.pdbqt | data/3P/3PDJ-3PJ/3PDJ-3PJ_decoys.pdbqt | data/3P/3PDJ-3PJ/3PDJ-3PJ_decoy_scores.csv |
3PGL-RZX | data/3P/3PGL-RZX/3PGL-RZX_ligand.pdbqt | data/3P/3PGL-RZX/3PGL-RZX_target.pdbqt | data/3P/3PGL-RZX/3PGL-RZX_decoys.pdbqt | data/3P/3PGL-RZX/3PGL-RZX_decoy_scores.csv |
3PMX-808 | data/3P/3PMX-808/3PMX-808_ligand.pdbqt | data/3P/3PMX-808/3PMX-808_target.pdbqt | data/3P/3PMX-808/3PMX-808_decoys.pdbqt | data/3P/3PMX-808/3PMX-808_decoy_scores.csv |
3PFG-TLO | data/3P/3PFG-TLO/3PFG-TLO_ligand.pdbqt | data/3P/3PFG-TLO/3PFG-TLO_target.pdbqt | data/3P/3PFG-TLO/3PFG-TLO_decoys.pdbqt | data/3P/3PFG-TLO/3PFG-TLO_decoy_scores.csv |
3P2V-DOY | data/3P/3P2V-DOY/3P2V-DOY_ligand.pdbqt | data/3P/3P2V-DOY/3P2V-DOY_target.pdbqt | data/3P/3P2V-DOY/3P2V-DOY_decoys.pdbqt | data/3P/3P2V-DOY/3P2V-DOY_decoy_scores.csv |
3PEO-CU9 | data/3P/3PEO-CU9/3PEO-CU9_ligand.pdbqt | data/3P/3PEO-CU9/3PEO-CU9_target.pdbqt | data/3P/3PEO-CU9/3PEO-CU9_decoys.pdbqt | data/3P/3PEO-CU9/3PEO-CU9_decoy_scores.csv |
3P6M-DSO | data/3P/3P6M-DSO/3P6M-DSO_ligand.pdbqt | data/3P/3P6M-DSO/3P6M-DSO_target.pdbqt | data/3P/3P6M-DSO/3P6M-DSO_decoys.pdbqt | data/3P/3P6M-DSO/3P6M-DSO_decoy_scores.csv |
3P82-FMN | data/3P/3P82-FMN/3P82-FMN_ligand.pdbqt | data/3P/3P82-FMN/3P82-FMN_target.pdbqt | data/3P/3P82-FMN/3P82-FMN_decoys.pdbqt | data/3P/3P82-FMN/3P82-FMN_decoy_scores.csv |
3PWR-ROC | data/3P/3PWR-ROC/3PWR-ROC_ligand.pdbqt | data/3P/3PWR-ROC/3PWR-ROC_target.pdbqt | data/3P/3PWR-ROC/3PWR-ROC_decoys.pdbqt | data/3P/3PWR-ROC/3PWR-ROC_decoy_scores.csv |
3PYF-ANP | data/3P/3PYF-ANP/3PYF-ANP_ligand.pdbqt | data/3P/3PYF-ANP/3PYF-ANP_target.pdbqt | data/3P/3PYF-ANP/3PYF-ANP_decoys.pdbqt | data/3P/3PYF-ANP/3PYF-ANP_decoy_scores.csv |
3PCJ-INO | data/3P/3PCJ-INO/3PCJ-INO_ligand.pdbqt | data/3P/3PCJ-INO/3PCJ-INO_target.pdbqt | data/3P/3PCJ-INO/3PCJ-INO_decoys.pdbqt | data/3P/3PCJ-INO/3PCJ-INO_decoy_scores.csv |
3P8G-BEN | data/3P/3P8G-BEN/3P8G-BEN_ligand.pdbqt | data/3P/3P8G-BEN/3P8G-BEN_target.pdbqt | data/3P/3P8G-BEN/3P8G-BEN_decoys.pdbqt | data/3P/3P8G-BEN/3P8G-BEN_decoy_scores.csv |
3PPT-PAM | data/3P/3PPT-PAM/3PPT-PAM_ligand.pdbqt | data/3P/3PPT-PAM/3PPT-PAM_target.pdbqt | data/3P/3PPT-PAM/3PPT-PAM_decoys.pdbqt | data/3P/3PPT-PAM/3PPT-PAM_decoy_scores.csv |
3PO6-RDT | data/3P/3PO6-RDT/3PO6-RDT_ligand.pdbqt | data/3P/3PO6-RDT/3PO6-RDT_target.pdbqt | data/3P/3PO6-RDT/3PO6-RDT_decoys.pdbqt | data/3P/3PO6-RDT/3PO6-RDT_decoy_scores.csv |
3PR2-7MN | data/3P/3PR2-7MN/3PR2-7MN_ligand.pdbqt | data/3P/3PR2-7MN/3PR2-7MN_target.pdbqt | null | null |
3PEE-IHP | data/3P/3PEE-IHP/3PEE-IHP_ligand.pdbqt | data/3P/3PEE-IHP/3PEE-IHP_target.pdbqt | data/3P/3PEE-IHP/3PEE-IHP_decoys.pdbqt | data/3P/3PEE-IHP/3PEE-IHP_decoy_scores.csv |
3PYY-STI | data/3P/3PYY-STI/3PYY-STI_ligand.pdbqt | data/3P/3PYY-STI/3PYY-STI_target.pdbqt | data/3P/3PYY-STI/3PYY-STI_decoys.pdbqt | data/3P/3PYY-STI/3PYY-STI_decoy_scores.csv |
3PE2-E1B | data/3P/3PE2-E1B/3PE2-E1B_ligand.pdbqt | data/3P/3PE2-E1B/3PE2-E1B_target.pdbqt | data/3P/3PE2-E1B/3PE2-E1B_decoys.pdbqt | data/3P/3PE2-E1B/3PE2-E1B_decoy_scores.csv |
3PA8-IHP | data/3P/3PA8-IHP/3PA8-IHP_ligand.pdbqt | data/3P/3PA8-IHP/3PA8-IHP_target.pdbqt | data/3P/3PA8-IHP/3PA8-IHP_decoys.pdbqt | data/3P/3PA8-IHP/3PA8-IHP_decoy_scores.csv |
3PLR-U5P | data/3P/3PLR-U5P/3PLR-U5P_ligand.pdbqt | data/3P/3PLR-U5P/3PLR-U5P_target.pdbqt | data/3P/3PLR-U5P/3PLR-U5P_decoys.pdbqt | data/3P/3PLR-U5P/3PLR-U5P_decoy_scores.csv |
3POZ-03P | data/3P/3POZ-03P/3POZ-03P_ligand.pdbqt | data/3P/3POZ-03P/3POZ-03P_target.pdbqt | data/3P/3POZ-03P/3POZ-03P_decoys.pdbqt | data/3P/3POZ-03P/3POZ-03P_decoy_scores.csv |
3P1F-3PF | data/3P/3P1F-3PF/3P1F-3PF_ligand.pdbqt | data/3P/3P1F-3PF/3P1F-3PF_target.pdbqt | data/3P/3P1F-3PF/3P1F-3PF_decoys.pdbqt | data/3P/3P1F-3PF/3P1F-3PF_decoy_scores.csv |
3PN1-IWH | data/3P/3PN1-IWH/3PN1-IWH_ligand.pdbqt | data/3P/3PN1-IWH/3PN1-IWH_target.pdbqt | data/3P/3PN1-IWH/3PN1-IWH_decoys.pdbqt | data/3P/3PN1-IWH/3PN1-IWH_decoy_scores.csv |
3P5S-AVU | data/3P/3P5S-AVU/3P5S-AVU_ligand.pdbqt | data/3P/3P5S-AVU/3P5S-AVU_target.pdbqt | data/3P/3P5S-AVU/3P5S-AVU_decoys.pdbqt | data/3P/3P5S-AVU/3P5S-AVU_decoy_scores.csv |
3PT9-SAH | data/3P/3PT9-SAH/3PT9-SAH_ligand.pdbqt | data/3P/3PT9-SAH/3PT9-SAH_target.pdbqt | data/3P/3PT9-SAH/3PT9-SAH_decoys.pdbqt | data/3P/3PT9-SAH/3PT9-SAH_decoy_scores.csv |
3PLP-BBA | data/3P/3PLP-BBA/3PLP-BBA_ligand.pdbqt | data/3P/3PLP-BBA/3PLP-BBA_target.pdbqt | data/3P/3PLP-BBA/3PLP-BBA_decoys.pdbqt | data/3P/3PLP-BBA/3PLP-BBA_decoy_scores.csv |
3PKB-Y16 | data/3P/3PKB-Y16/3PKB-Y16_ligand.pdbqt | data/3P/3PKB-Y16/3PKB-Y16_target.pdbqt | data/3P/3PKB-Y16/3PKB-Y16_decoys.pdbqt | data/3P/3PKB-Y16/3PKB-Y16_decoy_scores.csv |
3PEA-FLC | data/3P/3PEA-FLC/3PEA-FLC_ligand.pdbqt | data/3P/3PEA-FLC/3PEA-FLC_target.pdbqt | data/3P/3PEA-FLC/3PEA-FLC_decoys.pdbqt | data/3P/3PEA-FLC/3PEA-FLC_decoy_scores.csv |
3PNH-H4B | data/3P/3PNH-H4B/3PNH-H4B_ligand.pdbqt | data/3P/3PNH-H4B/3PNH-H4B_target.pdbqt | null | null |
3PCV-LMT | data/3P/3PCV-LMT/3PCV-LMT_ligand.pdbqt | data/3P/3PCV-LMT/3PCV-LMT_target.pdbqt | data/3P/3PCV-LMT/3PCV-LMT_decoys.pdbqt | data/3P/3PCV-LMT/3PCV-LMT_decoy_scores.csv |
3PYH-3YH | data/3P/3PYH-3YH/3PYH-3YH_ligand.pdbqt | data/3P/3PYH-3YH/3PYH-3YH_target.pdbqt | data/3P/3PYH-3YH/3PYH-3YH_decoys.pdbqt | data/3P/3PYH-3YH/3PYH-3YH_decoy_scores.csv |
3P67-FMN | data/3P/3P67-FMN/3P67-FMN_ligand.pdbqt | data/3P/3P67-FMN/3P67-FMN_target.pdbqt | data/3P/3P67-FMN/3P67-FMN_decoys.pdbqt | data/3P/3P67-FMN/3P67-FMN_decoy_scores.csv |
3PLZ-470 | data/3P/3PLZ-470/3PLZ-470_ligand.pdbqt | data/3P/3PLZ-470/3PLZ-470_target.pdbqt | data/3P/3PLZ-470/3PLZ-470_decoys.pdbqt | data/3P/3PLZ-470/3PLZ-470_decoy_scores.csv |
3P1H-THP | data/3P/3P1H-THP/3P1H-THP_ligand.pdbqt | data/3P/3P1H-THP/3P1H-THP_target.pdbqt | data/3P/3P1H-THP/3P1H-THP_decoys.pdbqt | data/3P/3P1H-THP/3P1H-THP_decoy_scores.csv |
3PIX-027 | data/3P/3PIX-027/3PIX-027_ligand.pdbqt | data/3P/3PIX-027/3PIX-027_target.pdbqt | data/3P/3PIX-027/3PIX-027_decoys.pdbqt | data/3P/3PIX-027/3PIX-027_decoy_scores.csv |
3PJK-AZA | data/3P/3PJK-AZA/3PJK-AZA_ligand.pdbqt | data/3P/3PJK-AZA/3PJK-AZA_target.pdbqt | null | null |
3PZH-EMO | data/3P/3PZH-EMO/3PZH-EMO_ligand.pdbqt | data/3P/3PZH-EMO/3PZH-EMO_target.pdbqt | data/3P/3PZH-EMO/3PZH-EMO_decoys.pdbqt | data/3P/3PZH-EMO/3PZH-EMO_decoy_scores.csv |
3PBR-MER | data/3P/3PBR-MER/3PBR-MER_ligand.pdbqt | data/3P/3PBR-MER/3PBR-MER_target.pdbqt | data/3P/3PBR-MER/3PBR-MER_decoys.pdbqt | data/3P/3PBR-MER/3PBR-MER_decoy_scores.csv |
3PFH-T3Q | data/3P/3PFH-T3Q/3PFH-T3Q_ligand.pdbqt | data/3P/3PFH-T3Q/3PFH-T3Q_target.pdbqt | data/3P/3PFH-T3Q/3PFH-T3Q_decoys.pdbqt | data/3P/3PFH-T3Q/3PFH-T3Q_decoy_scores.csv |
3P3E-3P3 | data/3P/3P3E-3P3/3P3E-3P3_ligand.pdbqt | data/3P/3P3E-3P3/3P3E-3P3_target.pdbqt | data/3P/3P3E-3P3/3P3E-3P3_decoys.pdbqt | data/3P/3P3E-3P3/3P3E-3P3_decoy_scores.csv |
3PS1-ZH2 | data/3P/3PS1-ZH2/3PS1-ZH2_ligand.pdbqt | data/3P/3PS1-ZH2/3PS1-ZH2_target.pdbqt | data/3P/3PS1-ZH2/3PS1-ZH2_decoys.pdbqt | data/3P/3PS1-ZH2/3PS1-ZH2_decoy_scores.csv |
3PQD-FBP | data/3P/3PQD-FBP/3PQD-FBP_ligand.pdbqt | data/3P/3PQD-FBP/3PQD-FBP_target.pdbqt | data/3P/3PQD-FBP/3PQD-FBP_decoys.pdbqt | data/3P/3PQD-FBP/3PQD-FBP_decoy_scores.csv |
3PWC-ANH | data/3P/3PWC-ANH/3PWC-ANH_ligand.pdbqt | data/3P/3PWC-ANH/3PWC-ANH_target.pdbqt | data/3P/3PWC-ANH/3PWC-ANH_decoys.pdbqt | data/3P/3PWC-ANH/3PWC-ANH_decoy_scores.csv |
3PXZ-2AN | data/3P/3PXZ-2AN/3PXZ-2AN_ligand.pdbqt | data/3P/3PXZ-2AN/3PXZ-2AN_target.pdbqt | data/3P/3PXZ-2AN/3PXZ-2AN_decoys.pdbqt | data/3P/3PXZ-2AN/3PXZ-2AN_decoy_scores.csv |
3PHE-C9A | data/3P/3PHE-C9A/3PHE-C9A_ligand.pdbqt | data/3P/3PHE-C9A/3PHE-C9A_target.pdbqt | data/3P/3PHE-C9A/3PHE-C9A_decoys.pdbqt | data/3P/3PHE-C9A/3PHE-C9A_decoy_scores.csv |
3PM4-F5N | data/3P/3PM4-F5N/3PM4-F5N_ligand.pdbqt | data/3P/3PM4-F5N/3PM4-F5N_target.pdbqt | data/3P/3PM4-F5N/3PM4-F5N_decoys.pdbqt | data/3P/3PM4-F5N/3PM4-F5N_decoy_scores.csv |
3PWB-BEN | data/3P/3PWB-BEN/3PWB-BEN_ligand.pdbqt | data/3P/3PWB-BEN/3PWB-BEN_target.pdbqt | data/3P/3PWB-BEN/3PWB-BEN_decoys.pdbqt | data/3P/3PWB-BEN/3PWB-BEN_decoy_scores.csv |
3PXQ-2AN | data/3P/3PXQ-2AN/3PXQ-2AN_ligand.pdbqt | data/3P/3PXQ-2AN/3PXQ-2AN_target.pdbqt | data/3P/3PXQ-2AN/3PXQ-2AN_decoys.pdbqt | data/3P/3PXQ-2AN/3PXQ-2AN_decoy_scores.csv |
3PLE-AZA | data/3P/3PLE-AZA/3PLE-AZA_ligand.pdbqt | data/3P/3PLE-AZA/3PLE-AZA_target.pdbqt | null | null |
3PFG-SAM | data/3P/3PFG-SAM/3PFG-SAM_ligand.pdbqt | data/3P/3PFG-SAM/3PFG-SAM_target.pdbqt | data/3P/3PFG-SAM/3PFG-SAM_decoys.pdbqt | data/3P/3PFG-SAM/3PFG-SAM_decoy_scores.csv |
3PS3-UKW | data/3P/3PS3-UKW/3PS3-UKW_ligand.pdbqt | data/3P/3PS3-UKW/3PS3-UKW_target.pdbqt | data/3P/3PS3-UKW/3PS3-UKW_decoys.pdbqt | data/3P/3PS3-UKW/3PS3-UKW_decoy_scores.csv |
3P13-RIP | data/3P/3P13-RIP/3P13-RIP_ligand.pdbqt | data/3P/3P13-RIP/3P13-RIP_target.pdbqt | data/3P/3P13-RIP/3P13-RIP_decoys.pdbqt | data/3P/3P13-RIP/3P13-RIP_decoy_scores.csv |
3PYE-CDM | data/3P/3PYE-CDM/3PYE-CDM_ligand.pdbqt | data/3P/3PYE-CDM/3PYE-CDM_target.pdbqt | data/3P/3PYE-CDM/3PYE-CDM_decoys.pdbqt | data/3P/3PYE-CDM/3PYE-CDM_decoy_scores.csv |
3PX3-T3Q | data/3P/3PX3-T3Q/3PX3-T3Q_ligand.pdbqt | data/3P/3PX3-T3Q/3PX3-T3Q_target.pdbqt | data/3P/3PX3-T3Q/3PX3-T3Q_decoys.pdbqt | data/3P/3PX3-T3Q/3PX3-T3Q_decoy_scores.csv |
3PD6-PMP | data/3P/3PD6-PMP/3PD6-PMP_ligand.pdbqt | data/3P/3PD6-PMP/3PD6-PMP_target.pdbqt | data/3P/3PD6-PMP/3PD6-PMP_decoys.pdbqt | data/3P/3PD6-PMP/3PD6-PMP_decoy_scores.csv |
3P8P-LN6 | data/3P/3P8P-LN6/3P8P-LN6_ligand.pdbqt | data/3P/3P8P-LN6/3P8P-LN6_target.pdbqt | data/3P/3P8P-LN6/3P8P-LN6_decoys.pdbqt | data/3P/3P8P-LN6/3P8P-LN6_decoy_scores.csv |
3PCC-PHB | data/3P/3PCC-PHB/3PCC-PHB_ligand.pdbqt | data/3P/3PCC-PHB/3PCC-PHB_target.pdbqt | data/3P/3PCC-PHB/3PCC-PHB_decoys.pdbqt | data/3P/3PCC-PHB/3PCC-PHB_decoy_scores.csv |
3PO1-MKY | data/3P/3PO1-MKY/3PO1-MKY_ligand.pdbqt | data/3P/3PO1-MKY/3PO1-MKY_target.pdbqt | data/3P/3PO1-MKY/3PO1-MKY_decoys.pdbqt | data/3P/3PO1-MKY/3PO1-MKY_decoy_scores.csv |
Subsets and Splits
No community queries yet
The top public SQL queries from the community will appear here once available.