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 ⌀ |
|---|---|---|---|---|
3MCV-MCV | data/3M/3MCV-MCV/3MCV-MCV_ligand.pdbqt | data/3M/3MCV-MCV/3MCV-MCV_target.pdbqt | data/3M/3MCV-MCV/3MCV-MCV_decoys.pdbqt | data/3M/3MCV-MCV/3MCV-MCV_decoy_scores.csv |
3MPA-SB2 | data/3M/3MPA-SB2/3MPA-SB2_ligand.pdbqt | data/3M/3MPA-SB2/3MPA-SB2_target.pdbqt | data/3M/3MPA-SB2/3MPA-SB2_decoys.pdbqt | data/3M/3MPA-SB2/3MPA-SB2_decoy_scores.csv |
3MXG-XLS | data/3M/3MXG-XLS/3MXG-XLS_ligand.pdbqt | data/3M/3MXG-XLS/3MXG-XLS_target.pdbqt | data/3M/3MXG-XLS/3MXG-XLS_decoys.pdbqt | data/3M/3MXG-XLS/3MXG-XLS_decoy_scores.csv |
3MYT-EQU | data/3M/3MYT-EQU/3MYT-EQU_ligand.pdbqt | data/3M/3MYT-EQU/3MYT-EQU_target.pdbqt | data/3M/3MYT-EQU/3MYT-EQU_decoys.pdbqt | data/3M/3MYT-EQU/3MYT-EQU_decoy_scores.csv |
3MVV-THP | data/3M/3MVV-THP/3MVV-THP_ligand.pdbqt | data/3M/3MVV-THP/3MVV-THP_target.pdbqt | data/3M/3MVV-THP/3MVV-THP_decoys.pdbqt | data/3M/3MVV-THP/3MVV-THP_decoy_scores.csv |
3M40-J45 | data/3M/3M40-J45/3M40-J45_ligand.pdbqt | data/3M/3M40-J45/3M40-J45_target.pdbqt | data/3M/3M40-J45/3M40-J45_decoys.pdbqt | data/3M/3M40-J45/3M40-J45_decoy_scores.csv |
3MZI-FMN | data/3M/3MZI-FMN/3MZI-FMN_ligand.pdbqt | data/3M/3MZI-FMN/3MZI-FMN_target.pdbqt | data/3M/3MZI-FMN/3MZI-FMN_decoys.pdbqt | data/3M/3MZI-FMN/3MZI-FMN_decoy_scores.csv |
3M6G-ATP | data/3M/3M6G-ATP/3M6G-ATP_ligand.pdbqt | data/3M/3M6G-ATP/3M6G-ATP_target.pdbqt | data/3M/3M6G-ATP/3M6G-ATP_decoys.pdbqt | data/3M/3M6G-ATP/3M6G-ATP_decoy_scores.csv |
3MT9-18O | data/3M/3MT9-18O/3MT9-18O_ligand.pdbqt | data/3M/3MT9-18O/3MT9-18O_target.pdbqt | data/3M/3MT9-18O/3MT9-18O_decoys.pdbqt | data/3M/3MT9-18O/3MT9-18O_decoy_scores.csv |
3M8Z-HSX | data/3M/3M8Z-HSX/3M8Z-HSX_ligand.pdbqt | data/3M/3M8Z-HSX/3M8Z-HSX_target.pdbqt | data/3M/3M8Z-HSX/3M8Z-HSX_decoys.pdbqt | data/3M/3M8Z-HSX/3M8Z-HSX_decoy_scores.csv |
3MZ9-BHN | data/3M/3MZ9-BHN/3MZ9-BHN_ligand.pdbqt | data/3M/3MZ9-BHN/3MZ9-BHN_target.pdbqt | data/3M/3MZ9-BHN/3MZ9-BHN_decoys.pdbqt | data/3M/3MZ9-BHN/3MZ9-BHN_decoy_scores.csv |
3M8C-EQU | data/3M/3M8C-EQU/3M8C-EQU_ligand.pdbqt | data/3M/3M8C-EQU/3M8C-EQU_target.pdbqt | data/3M/3M8C-EQU/3M8C-EQU_decoys.pdbqt | data/3M/3M8C-EQU/3M8C-EQU_decoy_scores.csv |
3M32-TP7 | data/3M/3M32-TP7/3M32-TP7_ligand.pdbqt | data/3M/3M32-TP7/3M32-TP7_target.pdbqt | data/3M/3M32-TP7/3M32-TP7_decoys.pdbqt | data/3M/3M32-TP7/3M32-TP7_decoy_scores.csv |
3M2Y-BE0 | data/3M/3M2Y-BE0/3M2Y-BE0_ligand.pdbqt | data/3M/3M2Y-BE0/3M2Y-BE0_target.pdbqt | data/3M/3M2Y-BE0/3M2Y-BE0_decoys.pdbqt | data/3M/3M2Y-BE0/3M2Y-BE0_decoy_scores.csv |
3MOE-SPV | data/3M/3MOE-SPV/3MOE-SPV_ligand.pdbqt | data/3M/3MOE-SPV/3MOE-SPV_target.pdbqt | data/3M/3MOE-SPV/3MOE-SPV_decoys.pdbqt | data/3M/3MOE-SPV/3MOE-SPV_decoy_scores.csv |
3MSK-EV4 | data/3M/3MSK-EV4/3MSK-EV4_ligand.pdbqt | data/3M/3MSK-EV4/3MSK-EV4_target.pdbqt | data/3M/3MSK-EV4/3MSK-EV4_decoys.pdbqt | data/3M/3MSK-EV4/3MSK-EV4_decoy_scores.csv |
3MB8-IMH | data/3M/3MB8-IMH/3MB8-IMH_ligand.pdbqt | data/3M/3MB8-IMH/3MB8-IMH_target.pdbqt | data/3M/3MB8-IMH/3MB8-IMH_decoys.pdbqt | data/3M/3MB8-IMH/3MB8-IMH_decoy_scores.csv |
3MB7-14I | data/3M/3MB7-14I/3MB7-14I_ligand.pdbqt | data/3M/3MB7-14I/3MB7-14I_target.pdbqt | data/3M/3MB7-14I/3MB7-14I_decoys.pdbqt | data/3M/3MB7-14I/3MB7-14I_decoy_scores.csv |
3MO2-SAH | data/3M/3MO2-SAH/3MO2-SAH_ligand.pdbqt | data/3M/3MO2-SAH/3MO2-SAH_target.pdbqt | data/3M/3MO2-SAH/3MO2-SAH_decoys.pdbqt | data/3M/3MO2-SAH/3MO2-SAH_decoy_scores.csv |
3MI3-LYS | data/3M/3MI3-LYS/3MI3-LYS_ligand.pdbqt | data/3M/3MI3-LYS/3MI3-LYS_target.pdbqt | data/3M/3MI3-LYS/3MI3-LYS_decoys.pdbqt | data/3M/3MI3-LYS/3MI3-LYS_decoy_scores.csv |
3MS5-REE | data/3M/3MS5-REE/3MS5-REE_ligand.pdbqt | data/3M/3MS5-REE/3MS5-REE_target.pdbqt | data/3M/3MS5-REE/3MS5-REE_decoys.pdbqt | data/3M/3MS5-REE/3MS5-REE_decoy_scores.csv |
3MJY-IJZ | data/3M/3MJY-IJZ/3MJY-IJZ_ligand.pdbqt | data/3M/3MJY-IJZ/3MJY-IJZ_target.pdbqt | data/3M/3MJY-IJZ/3MJY-IJZ_decoys.pdbqt | data/3M/3MJY-IJZ/3MJY-IJZ_decoy_scores.csv |
3MPN-MTN | data/3M/3MPN-MTN/3MPN-MTN_ligand.pdbqt | data/3M/3MPN-MTN/3MPN-MTN_target.pdbqt | data/3M/3MPN-MTN/3MPN-MTN_decoys.pdbqt | data/3M/3MPN-MTN/3MPN-MTN_decoy_scores.csv |
3MF5-HJZ | data/3M/3MF5-HJZ/3MF5-HJZ_ligand.pdbqt | data/3M/3MF5-HJZ/3MF5-HJZ_target.pdbqt | data/3M/3MF5-HJZ/3MF5-HJZ_decoys.pdbqt | data/3M/3MF5-HJZ/3MF5-HJZ_decoy_scores.csv |
3MOZ-5IP | data/3M/3MOZ-5IP/3MOZ-5IP_ligand.pdbqt | data/3M/3MOZ-5IP/3MOZ-5IP_target.pdbqt | data/3M/3MOZ-5IP/3MOZ-5IP_decoys.pdbqt | data/3M/3MOZ-5IP/3MOZ-5IP_decoy_scores.csv |
3MXN-BEN | data/3M/3MXN-BEN/3MXN-BEN_ligand.pdbqt | data/3M/3MXN-BEN/3MXN-BEN_target.pdbqt | data/3M/3MXN-BEN/3MXN-BEN_decoys.pdbqt | data/3M/3MXN-BEN/3MXN-BEN_decoy_scores.csv |
3MVX-BHZ | data/3M/3MVX-BHZ/3MVX-BHZ_ligand.pdbqt | data/3M/3MVX-BHZ/3MVX-BHZ_target.pdbqt | data/3M/3MVX-BHZ/3MVX-BHZ_decoys.pdbqt | data/3M/3MVX-BHZ/3MVX-BHZ_decoy_scores.csv |
3MB6-01I | data/3M/3MB6-01I/3MB6-01I_ligand.pdbqt | data/3M/3MB6-01I/3MB6-01I_target.pdbqt | data/3M/3MB6-01I/3MB6-01I_decoys.pdbqt | data/3M/3MB6-01I/3MB6-01I_decoy_scores.csv |
3MV0-149 | data/3M/3MV0-149/3MV0-149_ligand.pdbqt | data/3M/3MV0-149/3MV0-149_target.pdbqt | data/3M/3MV0-149/3MV0-149_decoys.pdbqt | data/3M/3MV0-149/3MV0-149_decoy_scores.csv |
3M57-SAH | data/3M/3M57-SAH/3M57-SAH_ligand.pdbqt | data/3M/3M57-SAH/3M57-SAH_target.pdbqt | data/3M/3M57-SAH/3M57-SAH_decoys.pdbqt | data/3M/3M57-SAH/3M57-SAH_decoy_scores.csv |
3MYK-ANP | data/3M/3MYK-ANP/3MYK-ANP_ligand.pdbqt | data/3M/3MYK-ANP/3MYK-ANP_target.pdbqt | data/3M/3MYK-ANP/3MYK-ANP_decoys.pdbqt | data/3M/3MYK-ANP/3MYK-ANP_decoy_scores.csv |
3MCN-B57 | data/3M/3MCN-B57/3MCN-B57_ligand.pdbqt | data/3M/3MCN-B57/3MCN-B57_target.pdbqt | data/3M/3MCN-B57/3MCN-B57_decoys.pdbqt | data/3M/3MCN-B57/3MCN-B57_decoy_scores.csv |
3MBF-2FP | data/3M/3MBF-2FP/3MBF-2FP_ligand.pdbqt | data/3M/3MBF-2FP/3MBF-2FP_target.pdbqt | data/3M/3MBF-2FP/3MBF-2FP_decoys.pdbqt | data/3M/3MBF-2FP/3MBF-2FP_decoy_scores.csv |
3MDT-VOR | data/3M/3MDT-VOR/3MDT-VOR_ligand.pdbqt | data/3M/3MDT-VOR/3MDT-VOR_target.pdbqt | data/3M/3MDT-VOR/3MDT-VOR_decoys.pdbqt | data/3M/3MDT-VOR/3MDT-VOR_decoy_scores.csv |
3M2T-NAD | data/3M/3M2T-NAD/3M2T-NAD_ligand.pdbqt | data/3M/3M2T-NAD/3M2T-NAD_target.pdbqt | data/3M/3M2T-NAD/3M2T-NAD_decoys.pdbqt | data/3M/3M2T-NAD/3M2T-NAD_decoy_scores.csv |
3MQD-3MQ | data/3M/3MQD-3MQ/3MQD-3MQ_ligand.pdbqt | data/3M/3MQD-3MQ/3MQD-3MQ_target.pdbqt | data/3M/3MQD-3MQ/3MQD-3MQ_decoys.pdbqt | data/3M/3MQD-3MQ/3MQD-3MQ_decoy_scores.csv |
3MSS-STI | data/3M/3MSS-STI/3MSS-STI_ligand.pdbqt | data/3M/3MSS-STI/3MSS-STI_target.pdbqt | data/3M/3MSS-STI/3MSS-STI_decoys.pdbqt | data/3M/3MSS-STI/3MSS-STI_decoy_scores.csv |
3MKN-DNB | data/3M/3MKN-DNB/3MKN-DNB_ligand.pdbqt | data/3M/3MKN-DNB/3MKN-DNB_target.pdbqt | data/3M/3MKN-DNB/3MKN-DNB_decoys.pdbqt | data/3M/3MKN-DNB/3MKN-DNB_decoy_scores.csv |
3M5A-SAH | data/3M/3M5A-SAH/3M5A-SAH_ligand.pdbqt | data/3M/3M5A-SAH/3M5A-SAH_target.pdbqt | data/3M/3M5A-SAH/3M5A-SAH_decoys.pdbqt | data/3M/3M5A-SAH/3M5A-SAH_decoy_scores.csv |
3MOE-GTP | data/3M/3MOE-GTP/3MOE-GTP_ligand.pdbqt | data/3M/3MOE-GTP/3MOE-GTP_target.pdbqt | data/3M/3MOE-GTP/3MOE-GTP_decoys.pdbqt | data/3M/3MOE-GTP/3MOE-GTP_decoy_scores.csv |
3M0L-PSJ | data/3M/3M0L-PSJ/3M0L-PSJ_ligand.pdbqt | data/3M/3M0L-PSJ/3M0L-PSJ_target.pdbqt | data/3M/3M0L-PSJ/3M0L-PSJ_decoys.pdbqt | data/3M/3M0L-PSJ/3M0L-PSJ_decoy_scores.csv |
3M09-RAR | data/3M/3M09-RAR/3M09-RAR_ligand.pdbqt | data/3M/3M09-RAR/3M09-RAR_target.pdbqt | data/3M/3M09-RAR/3M09-RAR_decoys.pdbqt | data/3M/3M09-RAR/3M09-RAR_decoy_scores.csv |
3MT8-17T | data/3M/3MT8-17T/3MT8-17T_ligand.pdbqt | data/3M/3MT8-17T/3MT8-17T_target.pdbqt | data/3M/3MT8-17T/3MT8-17T_decoys.pdbqt | data/3M/3MT8-17T/3MT8-17T_decoy_scores.csv |
3MNP-DEX | data/3M/3MNP-DEX/3MNP-DEX_ligand.pdbqt | data/3M/3MNP-DEX/3MNP-DEX_target.pdbqt | data/3M/3MNP-DEX/3MNP-DEX_decoys.pdbqt | data/3M/3MNP-DEX/3MNP-DEX_decoy_scores.csv |
3M98-E02 | data/3M/3M98-E02/3M98-E02_ligand.pdbqt | data/3M/3M98-E02/3M98-E02_target.pdbqt | data/3M/3M98-E02/3M98-E02_decoys.pdbqt | data/3M/3M98-E02/3M98-E02_decoy_scores.csv |
3MKJ-PZP | data/3M/3MKJ-PZP/3MKJ-PZP_ligand.pdbqt | data/3M/3MKJ-PZP/3MKJ-PZP_target.pdbqt | data/3M/3MKJ-PZP/3MKJ-PZP_decoys.pdbqt | data/3M/3MKJ-PZP/3MKJ-PZP_decoy_scores.csv |
3M7W-DQA | data/3M/3M7W-DQA/3M7W-DQA_ligand.pdbqt | data/3M/3M7W-DQA/3M7W-DQA_target.pdbqt | data/3M/3M7W-DQA/3M7W-DQA_decoys.pdbqt | data/3M/3M7W-DQA/3M7W-DQA_decoy_scores.csv |
3MDU-NGQ | data/3M/3MDU-NGQ/3MDU-NGQ_ligand.pdbqt | data/3M/3MDU-NGQ/3MDU-NGQ_target.pdbqt | data/3M/3MDU-NGQ/3MDU-NGQ_decoys.pdbqt | data/3M/3MDU-NGQ/3MDU-NGQ_decoy_scores.csv |
3MQH-PE4 | data/3M/3MQH-PE4/3MQH-PE4_ligand.pdbqt | data/3M/3MQH-PE4/3MQH-PE4_target.pdbqt | data/3M/3MQH-PE4/3MQH-PE4_decoys.pdbqt | data/3M/3MQH-PE4/3MQH-PE4_decoy_scores.csv |
3MS4-21N | data/3M/3MS4-21N/3MS4-21N_ligand.pdbqt | data/3M/3MS4-21N/3MS4-21N_target.pdbqt | data/3M/3MS4-21N/3MS4-21N_decoys.pdbqt | data/3M/3MS4-21N/3MS4-21N_decoy_scores.csv |
3MJX-BIT | data/3M/3MJX-BIT/3MJX-BIT_ligand.pdbqt | data/3M/3MJX-BIT/3MJX-BIT_target.pdbqt | null | null |
3MAG-3MA | data/3M/3MAG-3MA/3MAG-3MA_ligand.pdbqt | data/3M/3MAG-3MA/3MAG-3MA_target.pdbqt | data/3M/3MAG-3MA/3MAG-3MA_decoys.pdbqt | data/3M/3MAG-3MA/3MAG-3MA_decoy_scores.csv |
3M36-M35 | data/3M/3M36-M35/3M36-M35_ligand.pdbqt | data/3M/3M36-M35/3M36-M35_target.pdbqt | data/3M/3M36-M35/3M36-M35_decoys.pdbqt | data/3M/3M36-M35/3M36-M35_decoy_scores.csv |
3MVM-39P | data/3M/3MVM-39P/3MVM-39P_ligand.pdbqt | data/3M/3MVM-39P/3MVM-39P_target.pdbqt | data/3M/3MVM-39P/3MVM-39P_decoys.pdbqt | data/3M/3MVM-39P/3MVM-39P_decoy_scores.csv |
3MB5-SAM | data/3M/3MB5-SAM/3MB5-SAM_ligand.pdbqt | data/3M/3MB5-SAM/3MB5-SAM_target.pdbqt | data/3M/3MB5-SAM/3MB5-SAM_decoys.pdbqt | data/3M/3MB5-SAM/3MB5-SAM_decoy_scores.csv |
3MFR-ANP | data/3M/3MFR-ANP/3MFR-ANP_ligand.pdbqt | data/3M/3MFR-ANP/3MFR-ANP_target.pdbqt | data/3M/3MFR-ANP/3MFR-ANP_decoys.pdbqt | data/3M/3MFR-ANP/3MFR-ANP_decoy_scores.csv |
3M3L-GLU | data/3M/3M3L-GLU/3M3L-GLU_ligand.pdbqt | data/3M/3M3L-GLU/3M3L-GLU_target.pdbqt | data/3M/3M3L-GLU/3M3L-GLU_decoys.pdbqt | data/3M/3M3L-GLU/3M3L-GLU_decoy_scores.csv |
3MFF-ARG | data/3M/3MFF-ARG/3MFF-ARG_ligand.pdbqt | data/3M/3MFF-ARG/3MFF-ARG_target.pdbqt | data/3M/3MFF-ARG/3MFF-ARG_decoys.pdbqt | data/3M/3MFF-ARG/3MFF-ARG_decoy_scores.csv |
3MWB-PHE | data/3M/3MWB-PHE/3MWB-PHE_ligand.pdbqt | data/3M/3MWB-PHE/3MWB-PHE_target.pdbqt | data/3M/3MWB-PHE/3MWB-PHE_decoys.pdbqt | data/3M/3MWB-PHE/3MWB-PHE_decoy_scores.csv |
3MJM-NCD | data/3M/3MJM-NCD/3MJM-NCD_ligand.pdbqt | data/3M/3MJM-NCD/3MJM-NCD_target.pdbqt | data/3M/3MJM-NCD/3MJM-NCD_decoys.pdbqt | data/3M/3MJM-NCD/3MJM-NCD_decoy_scores.csv |
3M56-SAH | data/3M/3M56-SAH/3M56-SAH_ligand.pdbqt | data/3M/3M56-SAH/3M56-SAH_target.pdbqt | data/3M/3M56-SAH/3M56-SAH_decoys.pdbqt | data/3M/3M56-SAH/3M56-SAH_decoy_scores.csv |
3MV5-XFE | data/3M/3MV5-XFE/3MV5-XFE_ligand.pdbqt | data/3M/3MV5-XFE/3MV5-XFE_target.pdbqt | data/3M/3MV5-XFE/3MV5-XFE_decoys.pdbqt | data/3M/3MV5-XFE/3MV5-XFE_decoy_scores.csv |
3M5K-FMN | data/3M/3M5K-FMN/3M5K-FMN_ligand.pdbqt | data/3M/3M5K-FMN/3M5K-FMN_target.pdbqt | data/3M/3M5K-FMN/3M5K-FMN_decoys.pdbqt | data/3M/3M5K-FMN/3M5K-FMN_decoy_scores.csv |
3MMF-D9H | data/3M/3MMF-D9H/3MMF-D9H_ligand.pdbqt | data/3M/3MMF-D9H/3MMF-D9H_target.pdbqt | data/3M/3MMF-D9H/3MMF-D9H_decoys.pdbqt | data/3M/3MMF-D9H/3MMF-D9H_decoy_scores.csv |
3MEK-SAM | data/3M/3MEK-SAM/3MEK-SAM_ligand.pdbqt | data/3M/3MEK-SAM/3MEK-SAM_target.pdbqt | data/3M/3MEK-SAM/3MEK-SAM_decoys.pdbqt | data/3M/3MEK-SAM/3MEK-SAM_decoy_scores.csv |
3M2Z-BFE | data/3M/3M2Z-BFE/3M2Z-BFE_ligand.pdbqt | data/3M/3M2Z-BFE/3M2Z-BFE_target.pdbqt | data/3M/3M2Z-BFE/3M2Z-BFE_decoys.pdbqt | data/3M/3M2Z-BFE/3M2Z-BFE_decoy_scores.csv |
3M53-SAH | data/3M/3M53-SAH/3M53-SAH_ligand.pdbqt | data/3M/3M53-SAH/3M53-SAH_target.pdbqt | data/3M/3M53-SAH/3M53-SAH_decoys.pdbqt | data/3M/3M53-SAH/3M53-SAH_decoy_scores.csv |
3M89-GSP | data/3M/3M89-GSP/3M89-GSP_ligand.pdbqt | data/3M/3M89-GSP/3M89-GSP_target.pdbqt | data/3M/3M89-GSP/3M89-GSP_decoys.pdbqt | data/3M/3M89-GSP/3M89-GSP_decoy_scores.csv |
3MTH-MPB | data/3M/3MTH-MPB/3MTH-MPB_ligand.pdbqt | data/3M/3MTH-MPB/3MTH-MPB_target.pdbqt | data/3M/3MTH-MPB/3MTH-MPB_decoys.pdbqt | data/3M/3MTH-MPB/3MTH-MPB_decoy_scores.csv |
3M6R-BB2 | data/3M/3M6R-BB2/3M6R-BB2_ligand.pdbqt | data/3M/3M6R-BB2/3M6R-BB2_target.pdbqt | data/3M/3M6R-BB2/3M6R-BB2_decoys.pdbqt | data/3M/3M6R-BB2/3M6R-BB2_decoy_scores.csv |
3MZ7-B3N | data/3M/3MZ7-B3N/3MZ7-B3N_ligand.pdbqt | data/3M/3MZ7-B3N/3MZ7-B3N_target.pdbqt | data/3M/3MZ7-B3N/3MZ7-B3N_decoys.pdbqt | data/3M/3MZ7-B3N/3MZ7-B3N_decoy_scores.csv |
3MAX-NHE | data/3M/3MAX-NHE/3MAX-NHE_ligand.pdbqt | data/3M/3MAX-NHE/3MAX-NHE_target.pdbqt | data/3M/3MAX-NHE/3MAX-NHE_decoys.pdbqt | data/3M/3MAX-NHE/3MAX-NHE_decoy_scores.csv |
3MQF-20X | data/3M/3MQF-20X/3MQF-20X_ligand.pdbqt | data/3M/3MQF-20X/3MQF-20X_target.pdbqt | data/3M/3MQF-20X/3MQF-20X_decoys.pdbqt | data/3M/3MQF-20X/3MQF-20X_decoy_scores.csv |
3MDV-CL6 | data/3M/3MDV-CL6/3MDV-CL6_ligand.pdbqt | data/3M/3MDV-CL6/3MDV-CL6_target.pdbqt | data/3M/3MDV-CL6/3MDV-CL6_decoys.pdbqt | data/3M/3MDV-CL6/3MDV-CL6_decoy_scores.csv |
3M0Y-RNS | data/3M/3M0Y-RNS/3M0Y-RNS_ligand.pdbqt | data/3M/3M0Y-RNS/3M0Y-RNS_target.pdbqt | data/3M/3M0Y-RNS/3M0Y-RNS_decoys.pdbqt | data/3M/3M0Y-RNS/3M0Y-RNS_decoy_scores.csv |
3MJG-NDG | data/3M/3MJG-NDG/3MJG-NDG_ligand.pdbqt | data/3M/3MJG-NDG/3MJG-NDG_target.pdbqt | data/3M/3MJG-NDG/3MJG-NDG_decoys.pdbqt | data/3M/3MJG-NDG/3MJG-NDG_decoy_scores.csv |
3MQ2-SAH | data/3M/3MQ2-SAH/3MQ2-SAH_ligand.pdbqt | data/3M/3MQ2-SAH/3MQ2-SAH_target.pdbqt | data/3M/3MQ2-SAH/3MQ2-SAH_decoys.pdbqt | data/3M/3MQ2-SAH/3MQ2-SAH_decoy_scores.csv |
3M5T-BFG | data/3M/3M5T-BFG/3M5T-BFG_ligand.pdbqt | data/3M/3M5T-BFG/3M5T-BFG_target.pdbqt | data/3M/3M5T-BFG/3M5T-BFG_decoys.pdbqt | data/3M/3M5T-BFG/3M5T-BFG_decoy_scores.csv |
3MV6-DHB | data/3M/3MV6-DHB/3MV6-DHB_ligand.pdbqt | data/3M/3MV6-DHB/3MV6-DHB_target.pdbqt | data/3M/3MV6-DHB/3MV6-DHB_decoys.pdbqt | data/3M/3MV6-DHB/3MV6-DHB_decoy_scores.csv |
3MCT-SAH | data/3M/3MCT-SAH/3MCT-SAH_ligand.pdbqt | data/3M/3MCT-SAH/3MCT-SAH_target.pdbqt | data/3M/3MCT-SAH/3MCT-SAH_decoys.pdbqt | data/3M/3MCT-SAH/3MCT-SAH_decoy_scores.csv |
3M4H-388 | data/3M/3M4H-388/3M4H-388_ligand.pdbqt | data/3M/3M4H-388/3M4H-388_target.pdbqt | data/3M/3M4H-388/3M4H-388_decoys.pdbqt | data/3M/3M4H-388/3M4H-388_decoy_scores.csv |
3M3X-JS7 | data/3M/3M3X-JS7/3M3X-JS7_ligand.pdbqt | data/3M/3M3X-JS7/3M3X-JS7_target.pdbqt | data/3M/3M3X-JS7/3M3X-JS7_decoys.pdbqt | data/3M/3M3X-JS7/3M3X-JS7_decoy_scores.csv |
3MBH-PXL | data/3M/3MBH-PXL/3MBH-PXL_ligand.pdbqt | data/3M/3MBH-PXL/3MBH-PXL_target.pdbqt | data/3M/3MBH-PXL/3MBH-PXL_decoys.pdbqt | data/3M/3MBH-PXL/3MBH-PXL_decoy_scores.csv |
3MAX-LLX | data/3M/3MAX-LLX/3MAX-LLX_ligand.pdbqt | data/3M/3MAX-LLX/3MAX-LLX_target.pdbqt | data/3M/3MAX-LLX/3MAX-LLX_decoys.pdbqt | data/3M/3MAX-LLX/3MAX-LLX_decoy_scores.csv |
3MMJ-IHP | data/3M/3MMJ-IHP/3MMJ-IHP_ligand.pdbqt | data/3M/3MMJ-IHP/3MMJ-IHP_target.pdbqt | data/3M/3MMJ-IHP/3MMJ-IHP_decoys.pdbqt | data/3M/3MMJ-IHP/3MMJ-IHP_decoy_scores.csv |
3MES-ADP | data/3M/3MES-ADP/3MES-ADP_ligand.pdbqt | data/3M/3MES-ADP/3MES-ADP_target.pdbqt | data/3M/3MES-ADP/3MES-ADP_decoys.pdbqt | data/3M/3MES-ADP/3MES-ADP_decoy_scores.csv |
3M0M-AOS | data/3M/3M0M-AOS/3M0M-AOS_ligand.pdbqt | data/3M/3M0M-AOS/3M0M-AOS_target.pdbqt | data/3M/3M0M-AOS/3M0M-AOS_decoys.pdbqt | data/3M/3M0M-AOS/3M0M-AOS_decoy_scores.csv |
3M67-E36 | data/3M/3M67-E36/3M67-E36_ligand.pdbqt | data/3M/3M67-E36/3M67-E36_target.pdbqt | data/3M/3M67-E36/3M67-E36_decoys.pdbqt | data/3M/3M67-E36/3M67-E36_decoy_scores.csv |
3M8U-GDS | data/3M/3M8U-GDS/3M8U-GDS_ligand.pdbqt | data/3M/3M8U-GDS/3M8U-GDS_target.pdbqt | data/3M/3M8U-GDS/3M8U-GDS_decoys.pdbqt | data/3M/3M8U-GDS/3M8U-GDS_decoy_scores.csv |
3MHU-FMN | data/3M/3MHU-FMN/3MHU-FMN_ligand.pdbqt | data/3M/3MHU-FMN/3MHU-FMN_target.pdbqt | data/3M/3MHU-FMN/3MHU-FMN_decoys.pdbqt | data/3M/3MHU-FMN/3MHU-FMN_decoy_scores.csv |
3MOW-B2B | data/3M/3MOW-B2B/3MOW-B2B_ligand.pdbqt | data/3M/3MOW-B2B/3MOW-B2B_target.pdbqt | data/3M/3MOW-B2B/3MOW-B2B_decoys.pdbqt | data/3M/3MOW-B2B/3MOW-B2B_decoy_scores.csv |
3MES-PT3 | data/3M/3MES-PT3/3MES-PT3_ligand.pdbqt | data/3M/3MES-PT3/3MES-PT3_target.pdbqt | data/3M/3MES-PT3/3MES-PT3_decoys.pdbqt | data/3M/3MES-PT3/3MES-PT3_decoy_scores.csv |
3MQG-U5P | data/3M/3MQG-U5P/3MQG-U5P_ligand.pdbqt | data/3M/3MQG-U5P/3MQG-U5P_target.pdbqt | data/3M/3MQG-U5P/3MQG-U5P_decoys.pdbqt | data/3M/3MQG-U5P/3MQG-U5P_decoy_scores.csv |
3MMT-2FP | data/3M/3MMT-2FP/3MMT-2FP_ligand.pdbqt | data/3M/3MMT-2FP/3MMT-2FP_target.pdbqt | data/3M/3MMT-2FP/3MMT-2FP_decoys.pdbqt | data/3M/3MMT-2FP/3MMT-2FP_decoy_scores.csv |
3MS9-STI | data/3M/3MS9-STI/3MS9-STI_ligand.pdbqt | data/3M/3MS9-STI/3MS9-STI_target.pdbqt | data/3M/3MS9-STI/3MS9-STI_decoys.pdbqt | data/3M/3MS9-STI/3MS9-STI_decoy_scores.csv |
3MNA-DWH | data/3M/3MNA-DWH/3MNA-DWH_ligand.pdbqt | data/3M/3MNA-DWH/3MNA-DWH_target.pdbqt | data/3M/3MNA-DWH/3MNA-DWH_decoys.pdbqt | data/3M/3MNA-DWH/3MNA-DWH_decoy_scores.csv |
3M2N-BCN | data/3M/3M2N-BCN/3M2N-BCN_ligand.pdbqt | data/3M/3M2N-BCN/3M2N-BCN_target.pdbqt | data/3M/3M2N-BCN/3M2N-BCN_decoys.pdbqt | data/3M/3M2N-BCN/3M2N-BCN_decoy_scores.csv |
3MXF-JQ1 | data/3M/3MXF-JQ1/3MXF-JQ1_ligand.pdbqt | data/3M/3MXF-JQ1/3MXF-JQ1_target.pdbqt | data/3M/3MXF-JQ1/3MXF-JQ1_decoys.pdbqt | data/3M/3MXF-JQ1/3MXF-JQ1_decoy_scores.csv |
3MVH-WFE | data/3M/3MVH-WFE/3MVH-WFE_ligand.pdbqt | data/3M/3MVH-WFE/3MVH-WFE_target.pdbqt | data/3M/3MVH-WFE/3MVH-WFE_decoys.pdbqt | data/3M/3MVH-WFE/3MVH-WFE_decoy_scores.csv |
3M08-RAR | data/3M/3M08-RAR/3M08-RAR_ligand.pdbqt | data/3M/3M08-RAR/3M08-RAR_target.pdbqt | data/3M/3M08-RAR/3M08-RAR_decoys.pdbqt | data/3M/3M08-RAR/3M08-RAR_decoy_scores.csv |
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