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 ⌀ |
|---|---|---|---|---|
3PY5-AMP | data/3P/3PY5-AMP/3PY5-AMP_ligand.pdbqt | data/3P/3PY5-AMP/3PY5-AMP_target.pdbqt | data/3P/3PY5-AMP/3PY5-AMP_decoys.pdbqt | data/3P/3PY5-AMP/3PY5-AMP_decoy_scores.csv |
3PWS-11C | data/3P/3PWS-11C/3PWS-11C_ligand.pdbqt | data/3P/3PWS-11C/3PWS-11C_target.pdbqt | data/3P/3PWS-11C/3PWS-11C_decoys.pdbqt | data/3P/3PWS-11C/3PWS-11C_decoy_scores.csv |
3PBW-UP6 | data/3P/3PBW-UP6/3PBW-UP6_ligand.pdbqt | data/3P/3PBW-UP6/3PBW-UP6_target.pdbqt | data/3P/3PBW-UP6/3PBW-UP6_decoys.pdbqt | data/3P/3PBW-UP6/3PBW-UP6_decoy_scores.csv |
3PKX-TOF | data/3P/3PKX-TOF/3PKX-TOF_ligand.pdbqt | data/3P/3PKX-TOF/3PKX-TOF_target.pdbqt | data/3P/3PKX-TOF/3PKX-TOF_decoys.pdbqt | data/3P/3PKX-TOF/3PKX-TOF_decoy_scores.csv |
3P5O-EAM | data/3P/3P5O-EAM/3P5O-EAM_ligand.pdbqt | data/3P/3P5O-EAM/3P5O-EAM_target.pdbqt | data/3P/3P5O-EAM/3P5O-EAM_decoys.pdbqt | data/3P/3P5O-EAM/3P5O-EAM_decoy_scores.csv |
3P2O-NAD | data/3P/3P2O-NAD/3P2O-NAD_ligand.pdbqt | data/3P/3P2O-NAD/3P2O-NAD_target.pdbqt | data/3P/3P2O-NAD/3P2O-NAD_decoys.pdbqt | data/3P/3P2O-NAD/3P2O-NAD_decoy_scores.csv |
3P8Z-SAH | data/3P/3P8Z-SAH/3P8Z-SAH_ligand.pdbqt | data/3P/3P8Z-SAH/3P8Z-SAH_target.pdbqt | data/3P/3P8Z-SAH/3P8Z-SAH_decoys.pdbqt | data/3P/3P8Z-SAH/3P8Z-SAH_decoy_scores.csv |
3P9F-AZA | data/3P/3P9F-AZA/3P9F-AZA_ligand.pdbqt | data/3P/3P9F-AZA/3P9F-AZA_target.pdbqt | data/3P/3P9F-AZA/3P9F-AZA_decoys.pdbqt | data/3P/3P9F-AZA/3P9F-AZA_decoy_scores.csv |
3PKF-AZA | data/3P/3PKF-AZA/3PKF-AZA_ligand.pdbqt | data/3P/3PKF-AZA/3PKF-AZA_target.pdbqt | null | null |
3PS1-UKW | data/3P/3PS1-UKW/3PS1-UKW_ligand.pdbqt | data/3P/3PS1-UKW/3PS1-UKW_target.pdbqt | data/3P/3PS1-UKW/3PS1-UKW_decoys.pdbqt | data/3P/3PS1-UKW/3PS1-UKW_decoy_scores.csv |
3P7A-P7A | data/3P/3P7A-P7A/3P7A-P7A_ligand.pdbqt | data/3P/3P7A-P7A/3P7A-P7A_target.pdbqt | data/3P/3P7A-P7A/3P7A-P7A_decoys.pdbqt | data/3P/3P7A-P7A/3P7A-P7A_decoy_scores.csv |
3PY1-SU9 | data/3P/3PY1-SU9/3PY1-SU9_ligand.pdbqt | data/3P/3PY1-SU9/3PY1-SU9_target.pdbqt | data/3P/3PY1-SU9/3PY1-SU9_decoys.pdbqt | data/3P/3PY1-SU9/3PY1-SU9_decoy_scores.csv |
3P81-FMN | data/3P/3P81-FMN/3P81-FMN_ligand.pdbqt | data/3P/3P81-FMN/3P81-FMN_target.pdbqt | data/3P/3P81-FMN/3P81-FMN_decoys.pdbqt | data/3P/3P81-FMN/3P81-FMN_decoy_scores.csv |
3PXX-NAD | data/3P/3PXX-NAD/3PXX-NAD_ligand.pdbqt | data/3P/3PXX-NAD/3PXX-NAD_target.pdbqt | data/3P/3PXX-NAD/3PXX-NAD_decoys.pdbqt | data/3P/3PXX-NAD/3PXX-NAD_decoy_scores.csv |
3P3U-3M4 | data/3P/3P3U-3M4/3P3U-3M4_ligand.pdbqt | data/3P/3P3U-3M4/3P3U-3M4_target.pdbqt | data/3P/3P3U-3M4/3P3U-3M4_decoys.pdbqt | data/3P/3P3U-3M4/3P3U-3M4_decoy_scores.csv |
3PA9-PMP | data/3P/3PA9-PMP/3PA9-PMP_ligand.pdbqt | data/3P/3PA9-PMP/3PA9-PMP_target.pdbqt | data/3P/3PA9-PMP/3PA9-PMP_decoys.pdbqt | data/3P/3PA9-PMP/3PA9-PMP_decoy_scores.csv |
3P73-16A | data/3P/3P73-16A/3P73-16A_ligand.pdbqt | data/3P/3P73-16A/3P73-16A_target.pdbqt | data/3P/3P73-16A/3P73-16A_decoys.pdbqt | data/3P/3P73-16A/3P73-16A_decoy_scores.csv |
3P1C-ALY | data/3P/3P1C-ALY/3P1C-ALY_ligand.pdbqt | data/3P/3P1C-ALY/3P1C-ALY_target.pdbqt | data/3P/3P1C-ALY/3P1C-ALY_decoys.pdbqt | data/3P/3P1C-ALY/3P1C-ALY_decoy_scores.csv |
3PFW-NAD | data/3P/3PFW-NAD/3PFW-NAD_ligand.pdbqt | data/3P/3PFW-NAD/3PFW-NAD_target.pdbqt | data/3P/3PFW-NAD/3PFW-NAD_decoys.pdbqt | data/3P/3PFW-NAD/3PFW-NAD_decoy_scores.csv |
3PC0-UP6 | data/3P/3PC0-UP6/3PC0-UP6_ligand.pdbqt | data/3P/3PC0-UP6/3PC0-UP6_target.pdbqt | data/3P/3PC0-UP6/3PC0-UP6_decoys.pdbqt | data/3P/3PC0-UP6/3PC0-UP6_decoy_scores.csv |
3P1Q-FSC | data/3P/3P1Q-FSC/3P1Q-FSC_ligand.pdbqt | data/3P/3P1Q-FSC/3P1Q-FSC_target.pdbqt | data/3P/3P1Q-FSC/3P1Q-FSC_decoys.pdbqt | data/3P/3P1Q-FSC/3P1Q-FSC_decoy_scores.csv |
3P6Z-0G6 | data/3P/3P6Z-0G6/3P6Z-0G6_ligand.pdbqt | data/3P/3P6Z-0G6/3P6Z-0G6_target.pdbqt | data/3P/3P6Z-0G6/3P6Z-0G6_decoys.pdbqt | data/3P/3P6Z-0G6/3P6Z-0G6_decoy_scores.csv |
3PZ1-3PZ | data/3P/3PZ1-3PZ/3PZ1-3PZ_ligand.pdbqt | data/3P/3PZ1-3PZ/3PZ1-3PZ_target.pdbqt | data/3P/3PZ1-3PZ/3PZ1-3PZ_decoys.pdbqt | data/3P/3PZ1-3PZ/3PZ1-3PZ_decoy_scores.csv |
3PZ2-GRG | data/3P/3PZ2-GRG/3PZ2-GRG_ligand.pdbqt | data/3P/3PZ2-GRG/3PZ2-GRG_target.pdbqt | data/3P/3PZ2-GRG/3PZ2-GRG_decoys.pdbqt | data/3P/3PZ2-GRG/3PZ2-GRG_decoy_scores.csv |
3PB8-AHN | data/3P/3PB8-AHN/3PB8-AHN_ligand.pdbqt | data/3P/3PB8-AHN/3PB8-AHN_target.pdbqt | data/3P/3PB8-AHN/3PB8-AHN_decoys.pdbqt | data/3P/3PB8-AHN/3PB8-AHN_decoy_scores.csv |
3PIT-GNP | data/3P/3PIT-GNP/3PIT-GNP_ligand.pdbqt | data/3P/3PIT-GNP/3PIT-GNP_target.pdbqt | data/3P/3PIT-GNP/3PIT-GNP_decoys.pdbqt | data/3P/3PIT-GNP/3PIT-GNP_decoy_scores.csv |
3P0W-GKR | data/3P/3P0W-GKR/3P0W-GKR_ligand.pdbqt | data/3P/3P0W-GKR/3P0W-GKR_target.pdbqt | data/3P/3P0W-GKR/3P0W-GKR_decoys.pdbqt | data/3P/3P0W-GKR/3P0W-GKR_decoy_scores.csv |
3PCN-DHY | data/3P/3PCN-DHY/3PCN-DHY_ligand.pdbqt | data/3P/3PCN-DHY/3PCN-DHY_target.pdbqt | data/3P/3PCN-DHY/3PCN-DHY_decoys.pdbqt | data/3P/3PCN-DHY/3PCN-DHY_decoy_scores.csv |
3P48-DUP | data/3P/3P48-DUP/3P48-DUP_ligand.pdbqt | data/3P/3P48-DUP/3P48-DUP_target.pdbqt | data/3P/3P48-DUP/3P48-DUP_decoys.pdbqt | data/3P/3P48-DUP/3P48-DUP_decoy_scores.csv |
3PXF-2AN | data/3P/3PXF-2AN/3PXF-2AN_ligand.pdbqt | data/3P/3PXF-2AN/3PXF-2AN_target.pdbqt | data/3P/3PXF-2AN/3PXF-2AN_decoys.pdbqt | data/3P/3PXF-2AN/3PXF-2AN_decoy_scores.csv |
3P4X-ADP | data/3P/3P4X-ADP/3P4X-ADP_ligand.pdbqt | data/3P/3P4X-ADP/3P4X-ADP_target.pdbqt | data/3P/3P4X-ADP/3P4X-ADP_decoys.pdbqt | data/3P/3P4X-ADP/3P4X-ADP_decoy_scores.csv |
3P89-89P | data/3P/3P89-89P/3P89-89P_ligand.pdbqt | data/3P/3P89-89P/3P89-89P_target.pdbqt | data/3P/3P89-89P/3P89-89P_decoys.pdbqt | data/3P/3P89-89P/3P89-89P_decoy_scores.csv |
3PVW-QRX | data/3P/3PVW-QRX/3PVW-QRX_ligand.pdbqt | data/3P/3PVW-QRX/3PVW-QRX_target.pdbqt | data/3P/3PVW-QRX/3PVW-QRX_decoys.pdbqt | data/3P/3PVW-QRX/3PVW-QRX_decoy_scores.csv |
3PKK-AZA | data/3P/3PKK-AZA/3PKK-AZA_ligand.pdbqt | data/3P/3PKK-AZA/3PKK-AZA_target.pdbqt | null | null |
3PB5-F63 | data/3P/3PB5-F63/3PB5-F63_ligand.pdbqt | data/3P/3PB5-F63/3PB5-F63_target.pdbqt | data/3P/3PB5-F63/3PB5-F63_decoys.pdbqt | data/3P/3PB5-F63/3PB5-F63_decoy_scores.csv |
3P81-P81 | data/3P/3P81-P81/3P81-P81_ligand.pdbqt | data/3P/3P81-P81/3P81-P81_target.pdbqt | data/3P/3P81-P81/3P81-P81_decoys.pdbqt | data/3P/3P81-P81/3P81-P81_decoy_scores.csv |
3PA5-C73 | data/3P/3PA5-C73/3PA5-C73_ligand.pdbqt | data/3P/3PA5-C73/3PA5-C73_target.pdbqt | data/3P/3PA5-C73/3PA5-C73_decoys.pdbqt | data/3P/3PA5-C73/3PA5-C73_decoy_scores.csv |
3P3G-3P3 | data/3P/3P3G-3P3/3P3G-3P3_ligand.pdbqt | data/3P/3P3G-3P3/3P3G-3P3_target.pdbqt | data/3P/3P3G-3P3/3P3G-3P3_decoys.pdbqt | data/3P/3P3G-3P3/3P3G-3P3_decoy_scores.csv |
3PSY-RB9 | data/3P/3PSY-RB9/3PSY-RB9_ligand.pdbqt | data/3P/3PSY-RB9/3PSY-RB9_target.pdbqt | data/3P/3PSY-RB9/3PSY-RB9_decoys.pdbqt | data/3P/3PSY-RB9/3PSY-RB9_decoy_scores.csv |
3PBQ-IM2 | data/3P/3PBQ-IM2/3PBQ-IM2_ligand.pdbqt | data/3P/3PBQ-IM2/3PBQ-IM2_target.pdbqt | data/3P/3PBQ-IM2/3PBQ-IM2_decoys.pdbqt | data/3P/3PBQ-IM2/3PBQ-IM2_decoy_scores.csv |
3P0Q-NNL | data/3P/3P0Q-NNL/3P0Q-NNL_ligand.pdbqt | data/3P/3P0Q-NNL/3P0Q-NNL_target.pdbqt | data/3P/3P0Q-NNL/3P0Q-NNL_decoys.pdbqt | data/3P/3P0Q-NNL/3P0Q-NNL_decoy_scores.csv |
3PFC-FER | data/3P/3PFC-FER/3PFC-FER_ligand.pdbqt | data/3P/3PFC-FER/3PFC-FER_target.pdbqt | data/3P/3PFC-FER/3PFC-FER_decoys.pdbqt | data/3P/3PFC-FER/3PFC-FER_decoy_scores.csv |
3PP6-PAM | data/3P/3PP6-PAM/3PP6-PAM_ligand.pdbqt | data/3P/3PP6-PAM/3PP6-PAM_target.pdbqt | data/3P/3PP6-PAM/3PP6-PAM_decoys.pdbqt | data/3P/3PP6-PAM/3PP6-PAM_decoy_scores.csv |
3PD9-HA5 | data/3P/3PD9-HA5/3PD9-HA5_ligand.pdbqt | data/3P/3PD9-HA5/3PD9-HA5_target.pdbqt | data/3P/3PD9-HA5/3PD9-HA5_decoys.pdbqt | data/3P/3PD9-HA5/3PD9-HA5_decoy_scores.csv |
3PXU-COD | data/3P/3PXU-COD/3PXU-COD_ligand.pdbqt | data/3P/3PXU-COD/3PXU-COD_target.pdbqt | data/3P/3PXU-COD/3PXU-COD_decoys.pdbqt | data/3P/3PXU-COD/3PXU-COD_decoy_scores.csv |
3P2H-MTA | data/3P/3P2H-MTA/3P2H-MTA_ligand.pdbqt | data/3P/3P2H-MTA/3P2H-MTA_target.pdbqt | data/3P/3P2H-MTA/3P2H-MTA_decoys.pdbqt | data/3P/3P2H-MTA/3P2H-MTA_decoy_scores.csv |
3PMW-G69 | data/3P/3PMW-G69/3PMW-G69_ligand.pdbqt | data/3P/3PMW-G69/3PMW-G69_target.pdbqt | data/3P/3PMW-G69/3PMW-G69_decoys.pdbqt | data/3P/3PMW-G69/3PMW-G69_decoy_scores.csv |
3PBV-UP6 | data/3P/3PBV-UP6/3PBV-UP6_ligand.pdbqt | data/3P/3PBV-UP6/3PBV-UP6_target.pdbqt | data/3P/3PBV-UP6/3PBV-UP6_decoys.pdbqt | data/3P/3PBV-UP6/3PBV-UP6_decoy_scores.csv |
3P4E-AMP | data/3P/3P4E-AMP/3P4E-AMP_ligand.pdbqt | data/3P/3P4E-AMP/3P4E-AMP_target.pdbqt | data/3P/3P4E-AMP/3P4E-AMP_decoys.pdbqt | data/3P/3P4E-AMP/3P4E-AMP_decoy_scores.csv |
3P8I-FMN | data/3P/3P8I-FMN/3P8I-FMN_ligand.pdbqt | data/3P/3P8I-FMN/3P8I-FMN_target.pdbqt | data/3P/3P8I-FMN/3P8I-FMN_decoys.pdbqt | data/3P/3P8I-FMN/3P8I-FMN_decoy_scores.csv |
3PX3-SAH | data/3P/3PX3-SAH/3PX3-SAH_ligand.pdbqt | data/3P/3PX3-SAH/3PX3-SAH_target.pdbqt | data/3P/3PX3-SAH/3PX3-SAH_decoys.pdbqt | data/3P/3PX3-SAH/3PX3-SAH_decoy_scores.csv |
3PGJ-SKM | data/3P/3PGJ-SKM/3PGJ-SKM_ligand.pdbqt | data/3P/3PGJ-SKM/3PGJ-SKM_target.pdbqt | data/3P/3PGJ-SKM/3PGJ-SKM_decoys.pdbqt | data/3P/3PGJ-SKM/3PGJ-SKM_decoy_scores.csv |
3PJE-TCL | data/3P/3PJE-TCL/3PJE-TCL_ligand.pdbqt | data/3P/3PJE-TCL/3PJE-TCL_target.pdbqt | data/3P/3PJE-TCL/3PJE-TCL_decoys.pdbqt | data/3P/3PJE-TCL/3PJE-TCL_decoy_scores.csv |
3PJ1-LHL | data/3P/3PJ1-LHL/3PJ1-LHL_ligand.pdbqt | data/3P/3PJ1-LHL/3PJ1-LHL_target.pdbqt | data/3P/3PJ1-LHL/3PJ1-LHL_decoys.pdbqt | data/3P/3PJ1-LHL/3PJ1-LHL_decoy_scores.csv |
3PNG-H4B | data/3P/3PNG-H4B/3PNG-H4B_ligand.pdbqt | data/3P/3PNG-H4B/3PNG-H4B_target.pdbqt | data/3P/3PNG-H4B/3PNG-H4B_decoys.pdbqt | data/3P/3PNG-H4B/3PNG-H4B_decoy_scores.csv |
3PD8-HA7 | data/3P/3PD8-HA7/3PD8-HA7_ligand.pdbqt | data/3P/3PD8-HA7/3PD8-HA7_target.pdbqt | data/3P/3PD8-HA7/3PD8-HA7_decoys.pdbqt | data/3P/3PD8-HA7/3PD8-HA7_decoy_scores.csv |
3PWK-L14 | data/3P/3PWK-L14/3PWK-L14_ligand.pdbqt | data/3P/3PWK-L14/3PWK-L14_target.pdbqt | data/3P/3PWK-L14/3PWK-L14_decoys.pdbqt | data/3P/3PWK-L14/3PWK-L14_decoy_scores.csv |
3PRC-MQ7 | data/3P/3PRC-MQ7/3PRC-MQ7_ligand.pdbqt | data/3P/3PRC-MQ7/3PRC-MQ7_target.pdbqt | data/3P/3PRC-MQ7/3PRC-MQ7_decoys.pdbqt | data/3P/3PRC-MQ7/3PRC-MQ7_decoy_scores.csv |
3PWS-A2P | data/3P/3PWS-A2P/3PWS-A2P_ligand.pdbqt | data/3P/3PWS-A2P/3PWS-A2P_target.pdbqt | data/3P/3PWS-A2P/3PWS-A2P_decoys.pdbqt | data/3P/3PWS-A2P/3PWS-A2P_decoy_scores.csv |
3PTM-G2F | data/3P/3PTM-G2F/3PTM-G2F_ligand.pdbqt | data/3P/3PTM-G2F/3PTM-G2F_target.pdbqt | data/3P/3PTM-G2F/3PTM-G2F_decoys.pdbqt | data/3P/3PTM-G2F/3PTM-G2F_decoy_scores.csv |
3P0Z-CTN | data/3P/3P0Z-CTN/3P0Z-CTN_ligand.pdbqt | data/3P/3P0Z-CTN/3P0Z-CTN_target.pdbqt | data/3P/3P0Z-CTN/3P0Z-CTN_decoys.pdbqt | data/3P/3P0Z-CTN/3P0Z-CTN_decoy_scores.csv |
3P3C-3P3 | data/3P/3P3C-3P3/3P3C-3P3_ligand.pdbqt | data/3P/3P3C-3P3/3P3C-3P3_target.pdbqt | data/3P/3P3C-3P3/3P3C-3P3_decoys.pdbqt | data/3P/3P3C-3P3/3P3C-3P3_decoy_scores.csv |
3PBS-AZR | data/3P/3PBS-AZR/3PBS-AZR_ligand.pdbqt | data/3P/3PBS-AZR/3PBS-AZR_target.pdbqt | data/3P/3PBS-AZR/3PBS-AZR_decoys.pdbqt | data/3P/3PBS-AZR/3PBS-AZR_decoy_scores.csv |
3PD3-A3T | data/3P/3PD3-A3T/3PD3-A3T_ligand.pdbqt | data/3P/3PD3-A3T/3PD3-A3T_target.pdbqt | data/3P/3PD3-A3T/3PD3-A3T_decoys.pdbqt | data/3P/3PD3-A3T/3PD3-A3T_decoy_scores.csv |
3PBB-PBD | data/3P/3PBB-PBD/3PBB-PBD_ligand.pdbqt | data/3P/3PBB-PBD/3PBB-PBD_target.pdbqt | data/3P/3PBB-PBD/3PBB-PBD_decoys.pdbqt | data/3P/3PBB-PBD/3PBB-PBD_decoy_scores.csv |
3PDN-SFG | data/3P/3PDN-SFG/3PDN-SFG_ligand.pdbqt | data/3P/3PDN-SFG/3PDN-SFG_target.pdbqt | data/3P/3PDN-SFG/3PDN-SFG_decoys.pdbqt | data/3P/3PDN-SFG/3PDN-SFG_decoy_scores.csv |
3P60-BMP | data/3P/3P60-BMP/3P60-BMP_ligand.pdbqt | data/3P/3P60-BMP/3P60-BMP_target.pdbqt | data/3P/3P60-BMP/3P60-BMP_decoys.pdbqt | data/3P/3P60-BMP/3P60-BMP_decoy_scores.csv |
3P3G-UKW | data/3P/3P3G-UKW/3P3G-UKW_ligand.pdbqt | data/3P/3P3G-UKW/3P3G-UKW_target.pdbqt | data/3P/3P3G-UKW/3P3G-UKW_decoys.pdbqt | data/3P/3P3G-UKW/3P3G-UKW_decoy_scores.csv |
3P4V-PMX | data/3P/3P4V-PMX/3P4V-PMX_ligand.pdbqt | data/3P/3P4V-PMX/3P4V-PMX_target.pdbqt | data/3P/3P4V-PMX/3P4V-PMX_decoys.pdbqt | data/3P/3P4V-PMX/3P4V-PMX_decoy_scores.csv |
3PKD-Y10 | data/3P/3PKD-Y10/3PKD-Y10_ligand.pdbqt | data/3P/3PKD-Y10/3PKD-Y10_target.pdbqt | data/3P/3PKD-Y10/3PKD-Y10_decoys.pdbqt | data/3P/3PKD-Y10/3PKD-Y10_decoy_scores.csv |
3PNH-8CX | data/3P/3PNH-8CX/3PNH-8CX_ligand.pdbqt | data/3P/3PNH-8CX/3PNH-8CX_target.pdbqt | null | null |
3P6D-ZGB | data/3P/3P6D-ZGB/3P6D-ZGB_ligand.pdbqt | data/3P/3P6D-ZGB/3P6D-ZGB_target.pdbqt | data/3P/3P6D-ZGB/3P6D-ZGB_decoys.pdbqt | data/3P/3P6D-ZGB/3P6D-ZGB_decoy_scores.csv |
3P2H-NOO | data/3P/3P2H-NOO/3P2H-NOO_ligand.pdbqt | data/3P/3P2H-NOO/3P2H-NOO_target.pdbqt | data/3P/3P2H-NOO/3P2H-NOO_decoys.pdbqt | data/3P/3P2H-NOO/3P2H-NOO_decoy_scores.csv |
3P8E-LN7 | data/3P/3P8E-LN7/3P8E-LN7_ligand.pdbqt | data/3P/3P8E-LN7/3P8E-LN7_target.pdbqt | data/3P/3P8E-LN7/3P8E-LN7_decoys.pdbqt | data/3P/3P8E-LN7/3P8E-LN7_decoy_scores.csv |
3P93-KDG | data/3P/3P93-KDG/3P93-KDG_ligand.pdbqt | data/3P/3P93-KDG/3P93-KDG_target.pdbqt | data/3P/3P93-KDG/3P93-KDG_decoys.pdbqt | data/3P/3P93-KDG/3P93-KDG_decoy_scores.csv |
3PHC-IM5 | data/3P/3PHC-IM5/3PHC-IM5_ligand.pdbqt | data/3P/3PHC-IM5/3PHC-IM5_target.pdbqt | data/3P/3PHC-IM5/3PHC-IM5_decoys.pdbqt | data/3P/3PHC-IM5/3PHC-IM5_decoy_scores.csv |
3PT1-F6P | data/3P/3PT1-F6P/3PT1-F6P_ligand.pdbqt | data/3P/3PT1-F6P/3PT1-F6P_target.pdbqt | data/3P/3PT1-F6P/3PT1-F6P_decoys.pdbqt | data/3P/3PT1-F6P/3PT1-F6P_decoy_scores.csv |
3PKG-AZA | data/3P/3PKG-AZA/3PKG-AZA_ligand.pdbqt | data/3P/3PKG-AZA/3PKG-AZA_target.pdbqt | null | null |
3PKC-Y08 | data/3P/3PKC-Y08/3PKC-Y08_ligand.pdbqt | data/3P/3PKC-Y08/3PKC-Y08_target.pdbqt | data/3P/3PKC-Y08/3PKC-Y08_decoys.pdbqt | data/3P/3PKC-Y08/3PKC-Y08_decoy_scores.csv |
3PCA-DHB | data/3P/3PCA-DHB/3PCA-DHB_ligand.pdbqt | data/3P/3PCA-DHB/3PCA-DHB_target.pdbqt | data/3P/3PCA-DHB/3PCA-DHB_decoys.pdbqt | data/3P/3PCA-DHB/3PCA-DHB_decoy_scores.csv |
3PLQ-RP2 | data/3P/3PLQ-RP2/3PLQ-RP2_ligand.pdbqt | data/3P/3PLQ-RP2/3PLQ-RP2_target.pdbqt | data/3P/3PLQ-RP2/3PLQ-RP2_decoys.pdbqt | data/3P/3PLQ-RP2/3PLQ-RP2_decoy_scores.csv |
3PZ4-FPP | data/3P/3PZ4-FPP/3PZ4-FPP_ligand.pdbqt | data/3P/3PZ4-FPP/3PZ4-FPP_target.pdbqt | data/3P/3PZ4-FPP/3PZ4-FPP_decoys.pdbqt | data/3P/3PZ4-FPP/3PZ4-FPP_decoy_scores.csv |
3P5R-FGG | data/3P/3P5R-FGG/3P5R-FGG_ligand.pdbqt | data/3P/3P5R-FGG/3P5R-FGG_target.pdbqt | data/3P/3P5R-FGG/3P5R-FGG_decoys.pdbqt | data/3P/3P5R-FGG/3P5R-FGG_decoy_scores.csv |
3PY0-SU9 | data/3P/3PY0-SU9/3PY0-SU9_ligand.pdbqt | data/3P/3PY0-SU9/3PY0-SU9_target.pdbqt | data/3P/3PY0-SU9/3PY0-SU9_decoys.pdbqt | data/3P/3PY0-SU9/3PY0-SU9_decoy_scores.csv |
3P6F-FBZ | data/3P/3P6F-FBZ/3P6F-FBZ_ligand.pdbqt | data/3P/3P6F-FBZ/3P6F-FBZ_target.pdbqt | data/3P/3P6F-FBZ/3P6F-FBZ_decoys.pdbqt | data/3P/3P6F-FBZ/3P6F-FBZ_decoy_scores.csv |
3P6E-ZGC | data/3P/3P6E-ZGC/3P6E-ZGC_ligand.pdbqt | data/3P/3P6E-ZGC/3P6E-ZGC_target.pdbqt | data/3P/3P6E-ZGC/3P6E-ZGC_decoys.pdbqt | data/3P/3P6E-ZGC/3P6E-ZGC_decoy_scores.csv |
3P74-FMN | data/3P/3P74-FMN/3P74-FMN_ligand.pdbqt | data/3P/3P74-FMN/3P74-FMN_target.pdbqt | data/3P/3P74-FMN/3P74-FMN_decoys.pdbqt | data/3P/3P74-FMN/3P74-FMN_decoy_scores.csv |
3PWG-GLR | data/3P/3PWG-GLR/3PWG-GLR_ligand.pdbqt | data/3P/3PWG-GLR/3PWG-GLR_target.pdbqt | data/3P/3PWG-GLR/3PWG-GLR_decoys.pdbqt | data/3P/3PWG-GLR/3PWG-GLR_decoy_scores.csv |
3PH3-RB5 | data/3P/3PH3-RB5/3PH3-RB5_ligand.pdbqt | data/3P/3PH3-RB5/3PH3-RB5_target.pdbqt | data/3P/3PH3-RB5/3PH3-RB5_decoys.pdbqt | data/3P/3PH3-RB5/3PH3-RB5_decoy_scores.csv |
3PAX-3MB | data/3P/3PAX-3MB/3PAX-3MB_ligand.pdbqt | data/3P/3PAX-3MB/3PAX-3MB_target.pdbqt | data/3P/3PAX-3MB/3PAX-3MB_decoys.pdbqt | data/3P/3PAX-3MB/3PAX-3MB_decoy_scores.csv |
3PNE-H4B | data/3P/3PNE-H4B/3PNE-H4B_ligand.pdbqt | data/3P/3PNE-H4B/3PNE-H4B_target.pdbqt | data/3P/3PNE-H4B/3PNE-H4B_decoys.pdbqt | data/3P/3PNE-H4B/3PNE-H4B_decoy_scores.csv |
3P6T-SBF | data/3P/3P6T-SBF/3P6T-SBF_ligand.pdbqt | data/3P/3P6T-SBF/3P6T-SBF_target.pdbqt | data/3P/3P6T-SBF/3P6T-SBF_decoys.pdbqt | data/3P/3P6T-SBF/3P6T-SBF_decoy_scores.csv |
3PQD-NAD | data/3P/3PQD-NAD/3PQD-NAD_ligand.pdbqt | data/3P/3PQD-NAD/3PQD-NAD_target.pdbqt | data/3P/3PQD-NAD/3PQD-NAD_decoys.pdbqt | data/3P/3PQD-NAD/3PQD-NAD_decoy_scores.csv |
3PKI-AR6 | data/3P/3PKI-AR6/3PKI-AR6_ligand.pdbqt | data/3P/3PKI-AR6/3PKI-AR6_target.pdbqt | data/3P/3PKI-AR6/3PKI-AR6_decoys.pdbqt | data/3P/3PKI-AR6/3PKI-AR6_decoy_scores.csv |
3PLD-F90 | data/3P/3PLD-F90/3PLD-F90_ligand.pdbqt | data/3P/3PLD-F90/3PLD-F90_target.pdbqt | data/3P/3PLD-F90/3PLD-F90_decoys.pdbqt | data/3P/3PLD-F90/3PLD-F90_decoy_scores.csv |
3P93-CS2 | data/3P/3P93-CS2/3P93-CS2_ligand.pdbqt | data/3P/3P93-CS2/3P93-CS2_target.pdbqt | data/3P/3P93-CS2/3P93-CS2_decoys.pdbqt | data/3P/3P93-CS2/3P93-CS2_decoy_scores.csv |
3PTB-BEN | data/3P/3PTB-BEN/3PTB-BEN_ligand.pdbqt | data/3P/3PTB-BEN/3PTB-BEN_target.pdbqt | data/3P/3PTB-BEN/3PTB-BEN_decoys.pdbqt | data/3P/3PTB-BEN/3PTB-BEN_decoy_scores.csv |
3P7C-P7C | data/3P/3P7C-P7C/3P7C-P7C_ligand.pdbqt | data/3P/3P7C-P7C/3P7C-P7C_target.pdbqt | data/3P/3P7C-P7C/3P7C-P7C_decoys.pdbqt | data/3P/3P7C-P7C/3P7C-P7C_decoy_scores.csv |
3PJE-NAD | data/3P/3PJE-NAD/3PJE-NAD_ligand.pdbqt | data/3P/3PJE-NAD/3PJE-NAD_target.pdbqt | data/3P/3PJE-NAD/3PJE-NAD_decoys.pdbqt | data/3P/3PJE-NAD/3PJE-NAD_decoy_scores.csv |
3PH4-AOS | data/3P/3PH4-AOS/3PH4-AOS_ligand.pdbqt | data/3P/3PH4-AOS/3PH4-AOS_target.pdbqt | data/3P/3PH4-AOS/3PH4-AOS_decoys.pdbqt | data/3P/3PH4-AOS/3PH4-AOS_decoy_scores.csv |
Subsets and Splits
No community queries yet
The top public SQL queries from the community will appear here once available.