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 ⌀ |
|---|---|---|---|---|
4YPF-4FS | data/4Y/4YPF-4FS/4YPF-4FS_ligand.pdbqt | data/4Y/4YPF-4FS/4YPF-4FS_target.pdbqt | data/4Y/4YPF-4FS/4YPF-4FS_decoys.pdbqt | data/4Y/4YPF-4FS/4YPF-4FS_decoy_scores.csv |
4YRG-HIS | data/4Y/4YRG-HIS/4YRG-HIS_ligand.pdbqt | data/4Y/4YRG-HIS/4YRG-HIS_target.pdbqt | data/4Y/4YRG-HIS/4YRG-HIS_decoys.pdbqt | data/4Y/4YRG-HIS/4YRG-HIS_decoy_scores.csv |
4Y5P-483 | data/4Y/4Y5P-483/4Y5P-483_ligand.pdbqt | data/4Y/4Y5P-483/4Y5P-483_target.pdbqt | data/4Y/4Y5P-483/4Y5P-483_decoys.pdbqt | data/4Y/4Y5P-483/4Y5P-483_decoy_scores.csv |
4YC0-5OF | data/4Y/4YC0-5OF/4YC0-5OF_ligand.pdbqt | data/4Y/4YC0-5OF/4YC0-5OF_target.pdbqt | data/4Y/4YC0-5OF/4YC0-5OF_decoys.pdbqt | data/4Y/4YC0-5OF/4YC0-5OF_decoy_scores.csv |
4YAO-FMN | data/4Y/4YAO-FMN/4YAO-FMN_ligand.pdbqt | data/4Y/4YAO-FMN/4YAO-FMN_target.pdbqt | data/4Y/4YAO-FMN/4YAO-FMN_decoys.pdbqt | data/4Y/4YAO-FMN/4YAO-FMN_decoy_scores.csv |
4YKU-4ER | data/4Y/4YKU-4ER/4YKU-4ER_ligand.pdbqt | data/4Y/4YKU-4ER/4YKU-4ER_target.pdbqt | data/4Y/4YKU-4ER/4YKU-4ER_decoys.pdbqt | data/4Y/4YKU-4ER/4YKU-4ER_decoy_scores.csv |
4YKH-BCN | data/4Y/4YKH-BCN/4YKH-BCN_ligand.pdbqt | data/4Y/4YKH-BCN/4YKH-BCN_target.pdbqt | data/4Y/4YKH-BCN/4YKH-BCN_decoys.pdbqt | data/4Y/4YKH-BCN/4YKH-BCN_decoy_scores.csv |
4YOG-4F5 | data/4Y/4YOG-4F5/4YOG-4F5_ligand.pdbqt | data/4Y/4YOG-4F5/4YOG-4F5_target.pdbqt | data/4Y/4YOG-4F5/4YOG-4F5_decoys.pdbqt | data/4Y/4YOG-4F5/4YOG-4F5_decoy_scores.csv |
4Y3S-46L | data/4Y/4Y3S-46L/4Y3S-46L_ligand.pdbqt | data/4Y/4Y3S-46L/4Y3S-46L_target.pdbqt | data/4Y/4Y3S-46L/4Y3S-46L_decoys.pdbqt | data/4Y/4Y3S-46L/4Y3S-46L_decoy_scores.csv |
4YYL-4KN | data/4Y/4YYL-4KN/4YYL-4KN_ligand.pdbqt | data/4Y/4YYL-4KN/4YYL-4KN_target.pdbqt | data/4Y/4YYL-4KN/4YYL-4KN_decoys.pdbqt | data/4Y/4YYL-4KN/4YYL-4KN_decoy_scores.csv |
4YTZ-URC | data/4Y/4YTZ-URC/4YTZ-URC_ligand.pdbqt | data/4Y/4YTZ-URC/4YTZ-URC_target.pdbqt | data/4Y/4YTZ-URC/4YTZ-URC_decoys.pdbqt | data/4Y/4YTZ-URC/4YTZ-URC_decoy_scores.csv |
4YRY-NAD | data/4Y/4YRY-NAD/4YRY-NAD_ligand.pdbqt | data/4Y/4YRY-NAD/4YRY-NAD_target.pdbqt | data/4Y/4YRY-NAD/4YRY-NAD_decoys.pdbqt | data/4Y/4YRY-NAD/4YRY-NAD_decoy_scores.csv |
4YRC-0P6 | data/4Y/4YRC-0P6/4YRC-0P6_ligand.pdbqt | data/4Y/4YRC-0P6/4YRC-0P6_target.pdbqt | data/4Y/4YRC-0P6/4YRC-0P6_decoys.pdbqt | data/4Y/4YRC-0P6/4YRC-0P6_decoy_scores.csv |
4Y3J-HIC | data/4Y/4Y3J-HIC/4Y3J-HIC_ligand.pdbqt | data/4Y/4Y3J-HIC/4Y3J-HIC_target.pdbqt | data/4Y/4Y3J-HIC/4Y3J-HIC_decoys.pdbqt | data/4Y/4Y3J-HIC/4Y3J-HIC_decoy_scores.csv |
4YMA-4E5 | data/4Y/4YMA-4E5/4YMA-4E5_ligand.pdbqt | data/4Y/4YMA-4E5/4YMA-4E5_target.pdbqt | data/4Y/4YMA-4E5/4YMA-4E5_decoys.pdbqt | data/4Y/4YMA-4E5/4YMA-4E5_decoy_scores.csv |
4Y93-746 | data/4Y/4Y93-746/4Y93-746_ligand.pdbqt | data/4Y/4Y93-746/4Y93-746_target.pdbqt | data/4Y/4Y93-746/4Y93-746_decoys.pdbqt | data/4Y/4Y93-746/4Y93-746_decoy_scores.csv |
4YT6-4JY | data/4Y/4YT6-4JY/4YT6-4JY_ligand.pdbqt | data/4Y/4YT6-4JY/4YT6-4JY_target.pdbqt | data/4Y/4YT6-4JY/4YT6-4JY_decoys.pdbqt | data/4Y/4YT6-4JY/4YT6-4JY_decoy_scores.csv |
4YX4-FB2 | data/4Y/4YX4-FB2/4YX4-FB2_ligand.pdbqt | data/4Y/4YX4-FB2/4YX4-FB2_target.pdbqt | data/4Y/4YX4-FB2/4YX4-FB2_decoys.pdbqt | data/4Y/4YX4-FB2/4YX4-FB2_decoy_scores.csv |
4YZI-OLA | data/4Y/4YZI-OLA/4YZI-OLA_ligand.pdbqt | data/4Y/4YZI-OLA/4YZI-OLA_target.pdbqt | data/4Y/4YZI-OLA/4YZI-OLA_decoys.pdbqt | data/4Y/4YZI-OLA/4YZI-OLA_decoy_scores.csv |
4YW5-G39 | data/4Y/4YW5-G39/4YW5-G39_ligand.pdbqt | data/4Y/4YW5-G39/4YW5-G39_target.pdbqt | data/4Y/4YW5-G39/4YW5-G39_decoys.pdbqt | data/4Y/4YW5-G39/4YW5-G39_decoy_scores.csv |
4YTQ-TGY | data/4Y/4YTQ-TGY/4YTQ-TGY_ligand.pdbqt | data/4Y/4YTQ-TGY/4YTQ-TGY_target.pdbqt | data/4Y/4YTQ-TGY/4YTQ-TGY_decoys.pdbqt | data/4Y/4YTQ-TGY/4YTQ-TGY_decoy_scores.csv |
4YS6-BGC | data/4Y/4YS6-BGC/4YS6-BGC_ligand.pdbqt | data/4Y/4YS6-BGC/4YS6-BGC_target.pdbqt | data/4Y/4YS6-BGC/4YS6-BGC_decoys.pdbqt | data/4Y/4YS6-BGC/4YS6-BGC_decoy_scores.csv |
4YD5-4AV | data/4Y/4YD5-4AV/4YD5-4AV_ligand.pdbqt | data/4Y/4YD5-4AV/4YD5-4AV_target.pdbqt | data/4Y/4YD5-4AV/4YD5-4AV_decoys.pdbqt | data/4Y/4YD5-4AV/4YD5-4AV_decoy_scores.csv |
4YJS-4DN | data/4Y/4YJS-4DN/4YJS-4DN_ligand.pdbqt | data/4Y/4YJS-4DN/4YJS-4DN_target.pdbqt | data/4Y/4YJS-4DN/4YJS-4DN_decoys.pdbqt | data/4Y/4YJS-4DN/4YJS-4DN_decoy_scores.csv |
4YI3-4D0 | data/4Y/4YI3-4D0/4YI3-4D0_ligand.pdbqt | data/4Y/4YI3-4D0/4YI3-4D0_target.pdbqt | data/4Y/4YI3-4D0/4YI3-4D0_decoys.pdbqt | data/4Y/4YI3-4D0/4YI3-4D0_decoy_scores.csv |
4YKZ-4EV | data/4Y/4YKZ-4EV/4YKZ-4EV_ligand.pdbqt | data/4Y/4YKZ-4EV/4YKZ-4EV_target.pdbqt | data/4Y/4YKZ-4EV/4YKZ-4EV_decoys.pdbqt | data/4Y/4YKZ-4EV/4YKZ-4EV_decoy_scores.csv |
4YH0-RET | data/4Y/4YH0-RET/4YH0-RET_ligand.pdbqt | data/4Y/4YH0-RET/4YH0-RET_target.pdbqt | data/4Y/4YH0-RET/4YH0-RET_decoys.pdbqt | data/4Y/4YH0-RET/4YH0-RET_decoy_scores.csv |
4YHK-4CC | data/4Y/4YHK-4CC/4YHK-4CC_ligand.pdbqt | data/4Y/4YHK-4CC/4YHK-4CC_target.pdbqt | data/4Y/4YHK-4CC/4YHK-4CC_decoys.pdbqt | data/4Y/4YHK-4CC/4YHK-4CC_decoy_scores.csv |
4Y39-45M | data/4Y/4Y39-45M/4Y39-45M_ligand.pdbqt | data/4Y/4Y39-45M/4Y39-45M_target.pdbqt | data/4Y/4Y39-45M/4Y39-45M_decoys.pdbqt | data/4Y/4Y39-45M/4Y39-45M_decoy_scores.csv |
4YDS-ATP | data/4Y/4YDS-ATP/4YDS-ATP_ligand.pdbqt | data/4Y/4YDS-ATP/4YDS-ATP_target.pdbqt | data/4Y/4YDS-ATP/4YDS-ATP_decoys.pdbqt | data/4Y/4YDS-ATP/4YDS-ATP_decoy_scores.csv |
4Y73-XPY | data/4Y/4Y73-XPY/4Y73-XPY_ligand.pdbqt | data/4Y/4Y73-XPY/4Y73-XPY_target.pdbqt | data/4Y/4Y73-XPY/4Y73-XPY_decoys.pdbqt | data/4Y/4Y73-XPY/4Y73-XPY_decoy_scores.csv |
4YB5-HIS | data/4Y/4YB5-HIS/4YB5-HIS_ligand.pdbqt | data/4Y/4YB5-HIS/4YB5-HIS_target.pdbqt | data/4Y/4YB5-HIS/4YB5-HIS_decoys.pdbqt | data/4Y/4YB5-HIS/4YB5-HIS_decoy_scores.csv |
4Y5Q-AMP | data/4Y/4Y5Q-AMP/4Y5Q-AMP_ligand.pdbqt | data/4Y/4Y5Q-AMP/4Y5Q-AMP_target.pdbqt | data/4Y/4Y5Q-AMP/4Y5Q-AMP_decoys.pdbqt | data/4Y/4Y5Q-AMP/4Y5Q-AMP_decoy_scores.csv |
4YQR-4HQ | data/4Y/4YQR-4HQ/4YQR-4HQ_ligand.pdbqt | data/4Y/4YQR-4HQ/4YQR-4HQ_target.pdbqt | data/4Y/4YQR-4HQ/4YQR-4HQ_decoys.pdbqt | data/4Y/4YQR-4HQ/4YQR-4HQ_decoy_scores.csv |
4Y0P-TE4 | data/4Y/4Y0P-TE4/4Y0P-TE4_ligand.pdbqt | data/4Y/4Y0P-TE4/4Y0P-TE4_target.pdbqt | data/4Y/4Y0P-TE4/4Y0P-TE4_decoys.pdbqt | data/4Y/4Y0P-TE4/4Y0P-TE4_decoy_scores.csv |
4Y9H-D12 | data/4Y/4Y9H-D12/4Y9H-D12_ligand.pdbqt | data/4Y/4Y9H-D12/4Y9H-D12_target.pdbqt | data/4Y/4Y9H-D12/4Y9H-D12_decoys.pdbqt | data/4Y/4Y9H-D12/4Y9H-D12_decoy_scores.csv |
4YRW-URC | data/4Y/4YRW-URC/4YRW-URC_ligand.pdbqt | data/4Y/4YRW-URC/4YRW-URC_target.pdbqt | data/4Y/4YRW-URC/4YRW-URC_decoys.pdbqt | data/4Y/4YRW-URC/4YRW-URC_decoy_scores.csv |
4YVG-SAM | data/4Y/4YVG-SAM/4YVG-SAM_ligand.pdbqt | data/4Y/4YVG-SAM/4YVG-SAM_target.pdbqt | data/4Y/4YVG-SAM/4YVG-SAM_decoys.pdbqt | data/4Y/4YVG-SAM/4YVG-SAM_decoy_scores.csv |
4YZN-4K5 | data/4Y/4YZN-4K5/4YZN-4K5_ligand.pdbqt | data/4Y/4YZN-4K5/4YZN-4K5_target.pdbqt | data/4Y/4YZN-4K5/4YZN-4K5_decoys.pdbqt | data/4Y/4YZN-4K5/4YZN-4K5_decoy_scores.csv |
4YFA-DKA | data/4Y/4YFA-DKA/4YFA-DKA_ligand.pdbqt | data/4Y/4YFA-DKA/4YFA-DKA_target.pdbqt | data/4Y/4YFA-DKA/4YFA-DKA_decoys.pdbqt | data/4Y/4YFA-DKA/4YFA-DKA_decoy_scores.csv |
4YB6-AMP | data/4Y/4YB6-AMP/4YB6-AMP_ligand.pdbqt | data/4Y/4YB6-AMP/4YB6-AMP_target.pdbqt | data/4Y/4YB6-AMP/4YB6-AMP_decoys.pdbqt | data/4Y/4YB6-AMP/4YB6-AMP_decoy_scores.csv |
4YQ5-FLC | data/4Y/4YQ5-FLC/4YQ5-FLC_ligand.pdbqt | data/4Y/4YQ5-FLC/4YQ5-FLC_target.pdbqt | data/4Y/4YQ5-FLC/4YQ5-FLC_decoys.pdbqt | data/4Y/4YQ5-FLC/4YQ5-FLC_decoy_scores.csv |
4Y3D-45N | data/4Y/4Y3D-45N/4Y3D-45N_ligand.pdbqt | data/4Y/4Y3D-45N/4Y3D-45N_target.pdbqt | data/4Y/4Y3D-45N/4Y3D-45N_decoys.pdbqt | data/4Y/4Y3D-45N/4Y3D-45N_decoy_scores.csv |
4YUY-S4M | data/4Y/4YUY-S4M/4YUY-S4M_ligand.pdbqt | data/4Y/4YUY-S4M/4YUY-S4M_target.pdbqt | data/4Y/4YUY-S4M/4YUY-S4M_decoys.pdbqt | data/4Y/4YUY-S4M/4YUY-S4M_decoy_scores.csv |
4YK5-4DV | data/4Y/4YK5-4DV/4YK5-4DV_ligand.pdbqt | data/4Y/4YK5-4DV/4YK5-4DV_target.pdbqt | data/4Y/4YK5-4DV/4YK5-4DV_decoys.pdbqt | data/4Y/4YK5-4DV/4YK5-4DV_decoy_scores.csv |
4Y7U-491 | data/4Y/4Y7U-491/4Y7U-491_ligand.pdbqt | data/4Y/4Y7U-491/4Y7U-491_target.pdbqt | data/4Y/4Y7U-491/4Y7U-491_decoys.pdbqt | data/4Y/4Y7U-491/4Y7U-491_decoy_scores.csv |
4Y58-47L | data/4Y/4Y58-47L/4Y58-47L_ligand.pdbqt | data/4Y/4Y58-47L/4Y58-47L_target.pdbqt | data/4Y/4Y58-47L/4Y58-47L_decoys.pdbqt | data/4Y/4Y58-47L/4Y58-47L_decoy_scores.csv |
4YBP-RET | data/4Y/4YBP-RET/4YBP-RET_ligand.pdbqt | data/4Y/4YBP-RET/4YBP-RET_target.pdbqt | data/4Y/4YBP-RET/4YBP-RET_decoys.pdbqt | data/4Y/4YBP-RET/4YBP-RET_decoy_scores.csv |
4YNK-YW2 | data/4Y/4YNK-YW2/4YNK-YW2_ligand.pdbqt | data/4Y/4YNK-YW2/4YNK-YW2_target.pdbqt | data/4Y/4YNK-YW2/4YNK-YW2_decoys.pdbqt | data/4Y/4YNK-YW2/4YNK-YW2_decoy_scores.csv |
4Y3F-78B | data/4Y/4Y3F-78B/4Y3F-78B_ligand.pdbqt | data/4Y/4Y3F-78B/4Y3F-78B_target.pdbqt | data/4Y/4Y3F-78B/4Y3F-78B_decoys.pdbqt | data/4Y/4Y3F-78B/4Y3F-78B_decoy_scores.csv |
4Y0Q-PX9 | data/4Y/4Y0Q-PX9/4Y0Q-PX9_ligand.pdbqt | data/4Y/4Y0Q-PX9/4Y0Q-PX9_target.pdbqt | data/4Y/4Y0Q-PX9/4Y0Q-PX9_decoys.pdbqt | data/4Y/4Y0Q-PX9/4Y0Q-PX9_decoy_scores.csv |
4YZ9-4K7 | data/4Y/4YZ9-4K7/4YZ9-4K7_ligand.pdbqt | data/4Y/4YZ9-4K7/4YZ9-4K7_target.pdbqt | data/4Y/4YZ9-4K7/4YZ9-4K7_decoys.pdbqt | data/4Y/4YZ9-4K7/4YZ9-4K7_decoy_scores.csv |
4YML-4F0 | data/4Y/4YML-4F0/4YML-4F0_ligand.pdbqt | data/4Y/4YML-4F0/4YML-4F0_target.pdbqt | data/4Y/4YML-4F0/4YML-4F0_decoys.pdbqt | data/4Y/4YML-4F0/4YML-4F0_decoy_scores.csv |
4YF1-FLC | data/4Y/4YF1-FLC/4YF1-FLC_ligand.pdbqt | data/4Y/4YF1-FLC/4YF1-FLC_target.pdbqt | data/4Y/4YF1-FLC/4YF1-FLC_decoys.pdbqt | data/4Y/4YF1-FLC/4YF1-FLC_decoy_scores.csv |
4YSX-E23 | data/4Y/4YSX-E23/4YSX-E23_ligand.pdbqt | data/4Y/4YSX-E23/4YSX-E23_target.pdbqt | data/4Y/4YSX-E23/4YSX-E23_decoys.pdbqt | data/4Y/4YSX-E23/4YSX-E23_decoy_scores.csv |
4YTA-BEN | data/4Y/4YTA-BEN/4YTA-BEN_ligand.pdbqt | data/4Y/4YTA-BEN/4YTA-BEN_target.pdbqt | data/4Y/4YTA-BEN/4YTA-BEN_decoys.pdbqt | data/4Y/4YTA-BEN/4YTA-BEN_decoy_scores.csv |
4YRJ-HIS | data/4Y/4YRJ-HIS/4YRJ-HIS_ligand.pdbqt | data/4Y/4YRJ-HIS/4YRJ-HIS_target.pdbqt | data/4Y/4YRJ-HIS/4YRJ-HIS_decoys.pdbqt | data/4Y/4YRJ-HIS/4YRJ-HIS_decoy_scores.csv |
4YMI-ADE | data/4Y/4YMI-ADE/4YMI-ADE_ligand.pdbqt | data/4Y/4YMI-ADE/4YMI-ADE_target.pdbqt | data/4Y/4YMI-ADE/4YMI-ADE_decoys.pdbqt | data/4Y/4YMI-ADE/4YMI-ADE_decoy_scores.csv |
4YLG-GDP | data/4Y/4YLG-GDP/4YLG-GDP_ligand.pdbqt | data/4Y/4YLG-GDP/4YLG-GDP_target.pdbqt | data/4Y/4YLG-GDP/4YLG-GDP_decoys.pdbqt | data/4Y/4YLG-GDP/4YLG-GDP_decoy_scores.csv |
4YGR-NHE | data/4Y/4YGR-NHE/4YGR-NHE_ligand.pdbqt | data/4Y/4YGR-NHE/4YGR-NHE_target.pdbqt | data/4Y/4YGR-NHE/4YGR-NHE_decoys.pdbqt | data/4Y/4YGR-NHE/4YGR-NHE_decoy_scores.csv |
4YUS-FMN | data/4Y/4YUS-FMN/4YUS-FMN_ligand.pdbqt | data/4Y/4YUS-FMN/4YUS-FMN_target.pdbqt | data/4Y/4YUS-FMN/4YUS-FMN_decoys.pdbqt | data/4Y/4YUS-FMN/4YUS-FMN_decoy_scores.csv |
4YHM-4CC | data/4Y/4YHM-4CC/4YHM-4CC_ligand.pdbqt | data/4Y/4YHM-4CC/4YHM-4CC_target.pdbqt | data/4Y/4YHM-4CC/4YHM-4CC_decoys.pdbqt | data/4Y/4YHM-4CC/4YHM-4CC_decoy_scores.csv |
4YHI-4CC | data/4Y/4YHI-4CC/4YHI-4CC_ligand.pdbqt | data/4Y/4YHI-4CC/4YHI-4CC_target.pdbqt | data/4Y/4YHI-4CC/4YHI-4CC_decoys.pdbqt | data/4Y/4YHI-4CC/4YHI-4CC_decoy_scores.csv |
4Y9B-MKS | data/4Y/4Y9B-MKS/4Y9B-MKS_ligand.pdbqt | data/4Y/4Y9B-MKS/4Y9B-MKS_target.pdbqt | data/4Y/4Y9B-MKS/4Y9B-MKS_decoys.pdbqt | data/4Y/4Y9B-MKS/4Y9B-MKS_decoy_scores.csv |
4Y0X-ADP | data/4Y/4Y0X-ADP/4Y0X-ADP_ligand.pdbqt | data/4Y/4Y0X-ADP/4Y0X-ADP_target.pdbqt | data/4Y/4Y0X-ADP/4Y0X-ADP_decoys.pdbqt | data/4Y/4Y0X-ADP/4Y0X-ADP_decoy_scores.csv |
4YPA-SAM | data/4Y/4YPA-SAM/4YPA-SAM_ligand.pdbqt | data/4Y/4YPA-SAM/4YPA-SAM_target.pdbqt | data/4Y/4YPA-SAM/4YPA-SAM_decoys.pdbqt | data/4Y/4YPA-SAM/4YPA-SAM_decoy_scores.csv |
4YFP-RET | data/4Y/4YFP-RET/4YFP-RET_ligand.pdbqt | data/4Y/4YFP-RET/4YFP-RET_target.pdbqt | data/4Y/4YFP-RET/4YFP-RET_decoys.pdbqt | data/4Y/4YFP-RET/4YFP-RET_decoy_scores.csv |
4YQB-4GM | data/4Y/4YQB-4GM/4YQB-4GM_ligand.pdbqt | data/4Y/4YQB-4GM/4YQB-4GM_target.pdbqt | data/4Y/4YQB-4GM/4YQB-4GM_decoys.pdbqt | data/4Y/4YQB-4GM/4YQB-4GM_decoy_scores.csv |
4YQS-4H9 | data/4Y/4YQS-4H9/4YQS-4H9_ligand.pdbqt | data/4Y/4YQS-4H9/4YQS-4H9_target.pdbqt | data/4Y/4YQS-4H9/4YQS-4H9_decoys.pdbqt | data/4Y/4YQS-4H9/4YQS-4H9_decoy_scores.csv |
4Y3Q-F02 | data/4Y/4Y3Q-F02/4Y3Q-F02_ligand.pdbqt | data/4Y/4Y3Q-F02/4Y3Q-F02_target.pdbqt | data/4Y/4Y3Q-F02/4Y3Q-F02_decoys.pdbqt | data/4Y/4Y3Q-F02/4Y3Q-F02_decoy_scores.csv |
4Y5H-519 | data/4Y/4Y5H-519/4Y5H-519_ligand.pdbqt | data/4Y/4Y5H-519/4Y5H-519_target.pdbqt | data/4Y/4Y5H-519/4Y5H-519_decoys.pdbqt | data/4Y/4Y5H-519/4Y5H-519_decoy_scores.csv |
4YMQ-ZBD | data/4Y/4YMQ-ZBD/4YMQ-ZBD_ligand.pdbqt | data/4Y/4YMQ-ZBD/4YMQ-ZBD_target.pdbqt | data/4Y/4YMQ-ZBD/4YMQ-ZBD_decoys.pdbqt | data/4Y/4YMQ-ZBD/4YMQ-ZBD_decoy_scores.csv |
4YK0-986 | data/4Y/4YK0-986/4YK0-986_ligand.pdbqt | data/4Y/4YK0-986/4YK0-986_target.pdbqt | data/4Y/4YK0-986/4YK0-986_decoys.pdbqt | data/4Y/4YK0-986/4YK0-986_decoy_scores.csv |
4YQ1-4FN | data/4Y/4YQ1-4FN/4YQ1-4FN_ligand.pdbqt | data/4Y/4YQ1-4FN/4YQ1-4FN_target.pdbqt | data/4Y/4YQ1-4FN/4YQ1-4FN_decoys.pdbqt | data/4Y/4YQ1-4FN/4YQ1-4FN_decoy_scores.csv |
4YV1-4K2 | data/4Y/4YV1-4K2/4YV1-4K2_ligand.pdbqt | data/4Y/4YV1-4K2/4YV1-4K2_target.pdbqt | data/4Y/4YV1-4K2/4YV1-4K2_decoys.pdbqt | data/4Y/4YV1-4K2/4YV1-4K2_decoy_scores.csv |
4YBK-4B7 | data/4Y/4YBK-4B7/4YBK-4B7_ligand.pdbqt | data/4Y/4YBK-4B7/4YBK-4B7_target.pdbqt | data/4Y/4YBK-4B7/4YBK-4B7_decoys.pdbqt | data/4Y/4YBK-4B7/4YBK-4B7_decoy_scores.csv |
4YFR-RET | data/4Y/4YFR-RET/4YFR-RET_ligand.pdbqt | data/4Y/4YFR-RET/4YFR-RET_target.pdbqt | data/4Y/4YFR-RET/4YFR-RET_decoys.pdbqt | data/4Y/4YFR-RET/4YFR-RET_decoy_scores.csv |
4YAD-4A7 | data/4Y/4YAD-4A7/4YAD-4A7_ligand.pdbqt | data/4Y/4YAD-4A7/4YAD-4A7_target.pdbqt | data/4Y/4YAD-4A7/4YAD-4A7_decoys.pdbqt | data/4Y/4YAD-4A7/4YAD-4A7_decoy_scores.csv |
4YJG-4DD | data/4Y/4YJG-4DD/4YJG-4DD_ligand.pdbqt | data/4Y/4YJG-4DD/4YJG-4DD_target.pdbqt | data/4Y/4YJG-4DD/4YJG-4DD_decoys.pdbqt | data/4Y/4YJG-4DD/4YJG-4DD_decoy_scores.csv |
4YQ3-4G1 | data/4Y/4YQ3-4G1/4YQ3-4G1_ligand.pdbqt | data/4Y/4YQ3-4G1/4YQ3-4G1_target.pdbqt | data/4Y/4YQ3-4G1/4YQ3-4G1_decoys.pdbqt | data/4Y/4YQ3-4G1/4YQ3-4G1_decoy_scores.csv |
4YZL-DST | data/4Y/4YZL-DST/4YZL-DST_ligand.pdbqt | data/4Y/4YZL-DST/4YZL-DST_target.pdbqt | data/4Y/4YZL-DST/4YZL-DST_decoys.pdbqt | data/4Y/4YZL-DST/4YZL-DST_decoy_scores.csv |
4Y35-F90 | data/4Y/4Y35-F90/4Y35-F90_ligand.pdbqt | data/4Y/4Y35-F90/4Y35-F90_target.pdbqt | data/4Y/4Y35-F90/4Y35-F90_decoys.pdbqt | data/4Y/4Y35-F90/4Y35-F90_decoy_scores.csv |
4Y86-49E | data/4Y/4Y86-49E/4Y86-49E_ligand.pdbqt | data/4Y/4Y86-49E/4Y86-49E_target.pdbqt | data/4Y/4Y86-49E/4Y86-49E_decoys.pdbqt | data/4Y/4Y86-49E/4Y86-49E_decoy_scores.csv |
4YRN-HIS | data/4Y/4YRN-HIS/4YRN-HIS_ligand.pdbqt | data/4Y/4YRN-HIS/4YRN-HIS_target.pdbqt | data/4Y/4YRN-HIS/4YRN-HIS_decoys.pdbqt | data/4Y/4YRN-HIS/4YRN-HIS_decoy_scores.csv |
4Y7V-491 | data/4Y/4Y7V-491/4Y7V-491_ligand.pdbqt | data/4Y/4Y7V-491/4Y7V-491_target.pdbqt | data/4Y/4Y7V-491/4Y7V-491_decoys.pdbqt | data/4Y/4Y7V-491/4Y7V-491_decoy_scores.csv |
4YQH-4F7 | data/4Y/4YQH-4F7/4YQH-4F7_ligand.pdbqt | data/4Y/4YQH-4F7/4YQH-4F7_target.pdbqt | data/4Y/4YQH-4F7/4YQH-4F7_decoys.pdbqt | data/4Y/4YQH-4F7/4YQH-4F7_decoy_scores.csv |
4YCH-RET | data/4Y/4YCH-RET/4YCH-RET_ligand.pdbqt | data/4Y/4YCH-RET/4YCH-RET_target.pdbqt | data/4Y/4YCH-RET/4YCH-RET_decoys.pdbqt | data/4Y/4YCH-RET/4YCH-RET_decoy_scores.csv |
4YTS-TGR | data/4Y/4YTS-TGR/4YTS-TGR_ligand.pdbqt | data/4Y/4YTS-TGR/4YTS-TGR_target.pdbqt | data/4Y/4YTS-TGR/4YTS-TGR_decoys.pdbqt | data/4Y/4YTS-TGR/4YTS-TGR_decoy_scores.csv |
4Y3I-LBV | data/4Y/4Y3I-LBV/4Y3I-LBV_ligand.pdbqt | data/4Y/4Y3I-LBV/4Y3I-LBV_target.pdbqt | data/4Y/4Y3I-LBV/4Y3I-LBV_decoys.pdbqt | data/4Y/4Y3I-LBV/4Y3I-LBV_decoy_scores.csv |
4Y71-48W | data/4Y/4Y71-48W/4Y71-48W_ligand.pdbqt | data/4Y/4Y71-48W/4Y71-48W_target.pdbqt | data/4Y/4Y71-48W/4Y71-48W_decoys.pdbqt | data/4Y/4Y71-48W/4Y71-48W_decoy_scores.csv |
4YM9-4E4 | data/4Y/4YM9-4E4/4YM9-4E4_ligand.pdbqt | data/4Y/4YM9-4E4/4YM9-4E4_target.pdbqt | data/4Y/4YM9-4E4/4YM9-4E4_decoys.pdbqt | data/4Y/4YM9-4E4/4YM9-4E4_decoy_scores.csv |
4YWN-FLC | data/4Y/4YWN-FLC/4YWN-FLC_ligand.pdbqt | data/4Y/4YWN-FLC/4YWN-FLC_target.pdbqt | data/4Y/4YWN-FLC/4YWN-FLC_decoys.pdbqt | data/4Y/4YWN-FLC/4YWN-FLC_decoy_scores.csv |
4YPY-4F9 | data/4Y/4YPY-4F9/4YPY-4F9_ligand.pdbqt | data/4Y/4YPY-4F9/4YPY-4F9_target.pdbqt | data/4Y/4YPY-4F9/4YPY-4F9_decoys.pdbqt | data/4Y/4YPY-4F9/4YPY-4F9_decoy_scores.csv |
4YAI-GGE | data/4Y/4YAI-GGE/4YAI-GGE_ligand.pdbqt | data/4Y/4YAI-GGE/4YAI-GGE_target.pdbqt | data/4Y/4YAI-GGE/4YAI-GGE_decoys.pdbqt | data/4Y/4YAI-GGE/4YAI-GGE_decoy_scores.csv |
4YCE-RET | data/4Y/4YCE-RET/4YCE-RET_ligand.pdbqt | data/4Y/4YCE-RET/4YCE-RET_target.pdbqt | data/4Y/4YCE-RET/4YCE-RET_decoys.pdbqt | data/4Y/4YCE-RET/4YCE-RET_decoy_scores.csv |
4YKX-4ET | data/4Y/4YKX-4ET/4YKX-4ET_ligand.pdbqt | data/4Y/4YKX-4ET/4YKX-4ET_target.pdbqt | data/4Y/4YKX-4ET/4YKX-4ET_decoys.pdbqt | data/4Y/4YKX-4ET/4YKX-4ET_decoy_scores.csv |
4YQD-4GZ | data/4Y/4YQD-4GZ/4YQD-4GZ_ligand.pdbqt | data/4Y/4YQD-4GZ/4YQD-4GZ_target.pdbqt | data/4Y/4YQD-4GZ/4YQD-4GZ_decoys.pdbqt | data/4Y/4YQD-4GZ/4YQD-4GZ_decoy_scores.csv |
4YLL-4E3 | data/4Y/4YLL-4E3/4YLL-4E3_ligand.pdbqt | data/4Y/4YLL-4E3/4YLL-4E3_target.pdbqt | data/4Y/4YLL-4E3/4YLL-4E3_decoys.pdbqt | data/4Y/4YLL-4E3/4YLL-4E3_decoy_scores.csv |
4YKY-4EU | data/4Y/4YKY-4EU/4YKY-4EU_ligand.pdbqt | data/4Y/4YKY-4EU/4YKY-4EU_target.pdbqt | data/4Y/4YKY-4EU/4YKY-4EU_decoys.pdbqt | data/4Y/4YKY-4EU/4YKY-4EU_decoy_scores.csv |
4YZ7-9AR | data/4Y/4YZ7-9AR/4YZ7-9AR_ligand.pdbqt | data/4Y/4YZ7-9AR/4YZ7-9AR_target.pdbqt | data/4Y/4YZ7-9AR/4YZ7-9AR_decoys.pdbqt | data/4Y/4YZ7-9AR/4YZ7-9AR_decoy_scores.csv |
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