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 ⌀ |
|---|---|---|---|---|
1XGE-DOR | data/1X/1XGE-DOR/1XGE-DOR_ligand.pdbqt | data/1X/1XGE-DOR/1XGE-DOR_target.pdbqt | data/1X/1XGE-DOR/1XGE-DOR_decoys.pdbqt | data/1X/1XGE-DOR/1XGE-DOR_decoy_scores.csv |
1XH8-R55 | data/1X/1XH8-R55/1XH8-R55_ligand.pdbqt | data/1X/1XH8-R55/1XH8-R55_target.pdbqt | data/1X/1XH8-R55/1XH8-R55_decoys.pdbqt | data/1X/1XH8-R55/1XH8-R55_decoy_scores.csv |
1XOI-288 | data/1X/1XOI-288/1XOI-288_ligand.pdbqt | data/1X/1XOI-288/1XOI-288_target.pdbqt | data/1X/1XOI-288/1XOI-288_decoys.pdbqt | data/1X/1XOI-288/1XOI-288_decoy_scores.csv |
1XDD-AAY | data/1X/1XDD-AAY/1XDD-AAY_ligand.pdbqt | data/1X/1XDD-AAY/1XDD-AAY_target.pdbqt | data/1X/1XDD-AAY/1XDD-AAY_decoys.pdbqt | data/1X/1XDD-AAY/1XDD-AAY_decoy_scores.csv |
1XRJ-C5P | data/1X/1XRJ-C5P/1XRJ-C5P_ligand.pdbqt | data/1X/1XRJ-C5P/1XRJ-C5P_target.pdbqt | data/1X/1XRJ-C5P/1XRJ-C5P_decoys.pdbqt | data/1X/1XRJ-C5P/1XRJ-C5P_decoy_scores.csv |
1XL5-190 | data/1X/1XL5-190/1XL5-190_ligand.pdbqt | data/1X/1XL5-190/1XL5-190_target.pdbqt | data/1X/1XL5-190/1XL5-190_decoys.pdbqt | data/1X/1XL5-190/1XL5-190_decoy_scores.csv |
1XP1-AIH | data/1X/1XP1-AIH/1XP1-AIH_ligand.pdbqt | data/1X/1XP1-AIH/1XP1-AIH_target.pdbqt | data/1X/1XP1-AIH/1XP1-AIH_decoys.pdbqt | data/1X/1XP1-AIH/1XP1-AIH_decoy_scores.csv |
1XID-ASC | data/1X/1XID-ASC/1XID-ASC_ligand.pdbqt | data/1X/1XID-ASC/1XID-ASC_target.pdbqt | data/1X/1XID-ASC/1XID-ASC_decoys.pdbqt | data/1X/1XID-ASC/1XID-ASC_decoy_scores.csv |
1XMV-ADP | data/1X/1XMV-ADP/1XMV-ADP_ligand.pdbqt | data/1X/1XMV-ADP/1XMV-ADP_target.pdbqt | data/1X/1XMV-ADP/1XMV-ADP_decoys.pdbqt | data/1X/1XMV-ADP/1XMV-ADP_decoy_scores.csv |
1XG4-ICT | data/1X/1XG4-ICT/1XG4-ICT_ligand.pdbqt | data/1X/1XG4-ICT/1XG4-ICT_target.pdbqt | data/1X/1XG4-ICT/1XG4-ICT_decoys.pdbqt | data/1X/1XG4-ICT/1XG4-ICT_decoy_scores.csv |
1XJI-D10 | data/1X/1XJI-D10/1XJI-D10_ligand.pdbqt | data/1X/1XJI-D10/1XJI-D10_target.pdbqt | data/1X/1XJI-D10/1XJI-D10_decoys.pdbqt | data/1X/1XJI-D10/1XJI-D10_decoy_scores.csv |
1XC7-GL6 | data/1X/1XC7-GL6/1XC7-GL6_ligand.pdbqt | data/1X/1XC7-GL6/1XC7-GL6_target.pdbqt | data/1X/1XC7-GL6/1XC7-GL6_decoys.pdbqt | data/1X/1XC7-GL6/1XC7-GL6_decoy_scores.csv |
1XJQ-ADP | data/1X/1XJQ-ADP/1XJQ-ADP_ligand.pdbqt | data/1X/1XJQ-ADP/1XJQ-ADP_target.pdbqt | data/1X/1XJQ-ADP/1XJQ-ADP_decoys.pdbqt | data/1X/1XJQ-ADP/1XJQ-ADP_decoy_scores.csv |
1XL8-152 | data/1X/1XL8-152/1XL8-152_ligand.pdbqt | data/1X/1XL8-152/1XL8-152_target.pdbqt | data/1X/1XL8-152/1XL8-152_decoys.pdbqt | data/1X/1XL8-152/1XL8-152_decoy_scores.csv |
1XOI-NBG | data/1X/1XOI-NBG/1XOI-NBG_ligand.pdbqt | data/1X/1XOI-NBG/1XOI-NBG_target.pdbqt | data/1X/1XOI-NBG/1XOI-NBG_decoys.pdbqt | data/1X/1XOI-NBG/1XOI-NBG_decoy_scores.csv |
1X1Z-BMP | data/1X/1X1Z-BMP/1X1Z-BMP_ligand.pdbqt | data/1X/1X1Z-BMP/1X1Z-BMP_target.pdbqt | data/1X/1X1Z-BMP/1X1Z-BMP_decoys.pdbqt | data/1X/1X1Z-BMP/1X1Z-BMP_decoy_scores.csv |
1XW4-ADP | data/1X/1XW4-ADP/1XW4-ADP_ligand.pdbqt | data/1X/1XW4-ADP/1XW4-ADP_target.pdbqt | data/1X/1XW4-ADP/1XW4-ADP_decoys.pdbqt | data/1X/1XW4-ADP/1XW4-ADP_decoy_scores.csv |
1XYV-FMN | data/1X/1XYV-FMN/1XYV-FMN_ligand.pdbqt | data/1X/1XYV-FMN/1XYV-FMN_target.pdbqt | data/1X/1XYV-FMN/1XYV-FMN_decoys.pdbqt | data/1X/1XYV-FMN/1XYV-FMN_decoy_scores.csv |
1XLG-XYL | data/1X/1XLG-XYL/1XLG-XYL_ligand.pdbqt | data/1X/1XLG-XYL/1XLG-XYL_target.pdbqt | null | null |
1XEL-UPG | data/1X/1XEL-UPG/1XEL-UPG_ligand.pdbqt | data/1X/1XEL-UPG/1XEL-UPG_target.pdbqt | data/1X/1XEL-UPG/1XEL-UPG_decoys.pdbqt | data/1X/1XEL-UPG/1XEL-UPG_decoy_scores.csv |
1XSI-MPO | data/1X/1XSI-MPO/1XSI-MPO_ligand.pdbqt | data/1X/1XSI-MPO/1XSI-MPO_target.pdbqt | data/1X/1XSI-MPO/1XSI-MPO_decoys.pdbqt | data/1X/1XSI-MPO/1XSI-MPO_decoy_scores.csv |
1XOM-CIO | data/1X/1XOM-CIO/1XOM-CIO_ligand.pdbqt | data/1X/1XOM-CIO/1XOM-CIO_target.pdbqt | data/1X/1XOM-CIO/1XOM-CIO_decoys.pdbqt | data/1X/1XOM-CIO/1XOM-CIO_decoy_scores.csv |
1X9I-G6Q | data/1X/1X9I-G6Q/1X9I-G6Q_ligand.pdbqt | data/1X/1X9I-G6Q/1X9I-G6Q_target.pdbqt | data/1X/1X9I-G6Q/1X9I-G6Q_decoys.pdbqt | data/1X/1X9I-G6Q/1X9I-G6Q_decoy_scores.csv |
1XBO-IX1 | data/1X/1XBO-IX1/1XBO-IX1_ligand.pdbqt | data/1X/1XBO-IX1/1XBO-IX1_target.pdbqt | data/1X/1XBO-IX1/1XBO-IX1_decoys.pdbqt | data/1X/1XBO-IX1/1XBO-IX1_decoy_scores.csv |
1X2A-PDG | data/1X/1X2A-PDG/1X2A-PDG_ligand.pdbqt | data/1X/1X2A-PDG/1X2A-PDG_target.pdbqt | data/1X/1X2A-PDG/1X2A-PDG_decoys.pdbqt | data/1X/1X2A-PDG/1X2A-PDG_decoy_scores.csv |
1X8I-BMH | data/1X/1X8I-BMH/1X8I-BMH_ligand.pdbqt | data/1X/1X8I-BMH/1X8I-BMH_target.pdbqt | data/1X/1X8I-BMH/1X8I-BMH_decoys.pdbqt | data/1X/1X8I-BMH/1X8I-BMH_decoy_scores.csv |
1XYC-3MF | data/1X/1XYC-3MF/1XYC-3MF_ligand.pdbqt | data/1X/1XYC-3MF/1XYC-3MF_target.pdbqt | data/1X/1XYC-3MF/1XYC-3MF_decoys.pdbqt | data/1X/1XYC-3MF/1XYC-3MF_decoy_scores.csv |
1XUR-PB5 | data/1X/1XUR-PB5/1XUR-PB5_ligand.pdbqt | data/1X/1XUR-PB5/1XUR-PB5_target.pdbqt | data/1X/1XUR-PB5/1XUR-PB5_decoys.pdbqt | data/1X/1XUR-PB5/1XUR-PB5_decoy_scores.csv |
1X1S-GNP | data/1X/1X1S-GNP/1X1S-GNP_ligand.pdbqt | data/1X/1X1S-GNP/1X1S-GNP_target.pdbqt | data/1X/1X1S-GNP/1X1S-GNP_decoys.pdbqt | data/1X/1X1S-GNP/1X1S-GNP_decoy_scores.csv |
1X08-FPS | data/1X/1X08-FPS/1X08-FPS_ligand.pdbqt | data/1X/1X08-FPS/1X08-FPS_target.pdbqt | data/1X/1X08-FPS/1X08-FPS_decoys.pdbqt | data/1X/1X08-FPS/1X08-FPS_decoy_scores.csv |
1XH9-R69 | data/1X/1XH9-R69/1XH9-R69_ligand.pdbqt | data/1X/1XH9-R69/1XH9-R69_target.pdbqt | data/1X/1XH9-R69/1XH9-R69_decoys.pdbqt | data/1X/1XH9-R69/1XH9-R69_decoy_scores.csv |
5TKL-P6F | data/5T/5TKL-P6F/5TKL-P6F_ligand.pdbqt | data/5T/5TKL-P6F/5TKL-P6F_target.pdbqt | data/5T/5TKL-P6F/5TKL-P6F_decoys.pdbqt | data/5T/5TKL-P6F/5TKL-P6F_decoy_scores.csv |
5TFD-CTP | data/5T/5TFD-CTP/5TFD-CTP_ligand.pdbqt | data/5T/5TFD-CTP/5TFD-CTP_target.pdbqt | data/5T/5TFD-CTP/5TFD-CTP_decoys.pdbqt | data/5T/5TFD-CTP/5TFD-CTP_decoy_scores.csv |
5TN6-7G1 | data/5T/5TN6-7G1/5TN6-7G1_ligand.pdbqt | data/5T/5TN6-7G1/5TN6-7G1_target.pdbqt | data/5T/5TN6-7G1/5TN6-7G1_decoys.pdbqt | data/5T/5TN6-7G1/5TN6-7G1_decoy_scores.csv |
5TV1-IHP | data/5T/5TV1-IHP/5TV1-IHP_ligand.pdbqt | data/5T/5TV1-IHP/5TV1-IHP_target.pdbqt | data/5T/5TV1-IHP/5TV1-IHP_decoys.pdbqt | data/5T/5TV1-IHP/5TV1-IHP_decoy_scores.csv |
5TVA-AMP | data/5T/5TVA-AMP/5TVA-AMP_ligand.pdbqt | data/5T/5TVA-AMP/5TVA-AMP_target.pdbqt | data/5T/5TVA-AMP/5TVA-AMP_decoys.pdbqt | data/5T/5TVA-AMP/5TVA-AMP_decoy_scores.csv |
5TKP-P6F | data/5T/5TKP-P6F/5TKP-P6F_ligand.pdbqt | data/5T/5TKP-P6F/5TKP-P6F_target.pdbqt | data/5T/5TKP-P6F/5TKP-P6F_decoys.pdbqt | data/5T/5TKP-P6F/5TKP-P6F_decoy_scores.csv |
5TG1-V56 | data/5T/5TG1-V56/5TG1-V56_ligand.pdbqt | data/5T/5TG1-V56/5TG1-V56_target.pdbqt | data/5T/5TG1-V56/5TG1-V56_decoys.pdbqt | data/5T/5TG1-V56/5TG1-V56_decoy_scores.csv |
5TZA-7OG | data/5T/5TZA-7OG/5TZA-7OG_ligand.pdbqt | data/5T/5TZA-7OG/5TZA-7OG_target.pdbqt | data/5T/5TZA-7OG/5TZA-7OG_decoys.pdbqt | data/5T/5TZA-7OG/5TZA-7OG_decoy_scores.csv |
5T5J-A2G | data/5T/5T5J-A2G/5T5J-A2G_ligand.pdbqt | data/5T/5T5J-A2G/5T5J-A2G_target.pdbqt | data/5T/5T5J-A2G/5T5J-A2G_decoys.pdbqt | data/5T/5T5J-A2G/5T5J-A2G_decoy_scores.csv |
5TEQ-FLC | data/5T/5TEQ-FLC/5TEQ-FLC_ligand.pdbqt | data/5T/5TEQ-FLC/5TEQ-FLC_target.pdbqt | data/5T/5TEQ-FLC/5TEQ-FLC_decoys.pdbqt | data/5T/5TEQ-FLC/5TEQ-FLC_decoy_scores.csv |
5T46-MGP | data/5T/5T46-MGP/5T46-MGP_ligand.pdbqt | data/5T/5T46-MGP/5T46-MGP_target.pdbqt | data/5T/5T46-MGP/5T46-MGP_decoys.pdbqt | data/5T/5T46-MGP/5T46-MGP_decoy_scores.csv |
5TS8-7M0 | data/5T/5TS8-7M0/5TS8-7M0_ligand.pdbqt | data/5T/5TS8-7M0/5TS8-7M0_target.pdbqt | data/5T/5TS8-7M0/5TS8-7M0_decoys.pdbqt | data/5T/5TS8-7M0/5TS8-7M0_decoy_scores.csv |
5TTG-SAM | data/5T/5TTG-SAM/5TTG-SAM_ligand.pdbqt | data/5T/5TTG-SAM/5TTG-SAM_target.pdbqt | data/5T/5TTG-SAM/5TTG-SAM_decoys.pdbqt | data/5T/5TTG-SAM/5TTG-SAM_decoy_scores.csv |
5TCM-R78 | data/5T/5TCM-R78/5TCM-R78_ligand.pdbqt | data/5T/5TCM-R78/5TCM-R78_target.pdbqt | data/5T/5TCM-R78/5TCM-R78_decoys.pdbqt | data/5T/5TCM-R78/5TCM-R78_decoy_scores.csv |
5TC6-7A6 | data/5T/5TC6-7A6/5TC6-7A6_ligand.pdbqt | data/5T/5TC6-7A6/5TC6-7A6_target.pdbqt | data/5T/5TC6-7A6/5TC6-7A6_decoys.pdbqt | data/5T/5TC6-7A6/5TC6-7A6_decoy_scores.csv |
5T7E-BNG | data/5T/5T7E-BNG/5T7E-BNG_ligand.pdbqt | data/5T/5T7E-BNG/5T7E-BNG_target.pdbqt | data/5T/5T7E-BNG/5T7E-BNG_decoys.pdbqt | data/5T/5T7E-BNG/5T7E-BNG_decoy_scores.csv |
5TEJ-7FN | data/5T/5TEJ-7FN/5TEJ-7FN_ligand.pdbqt | data/5T/5TEJ-7FN/5TEJ-7FN_target.pdbqt | data/5T/5TEJ-7FN/5TEJ-7FN_decoys.pdbqt | data/5T/5TEJ-7FN/5TEJ-7FN_decoy_scores.csv |
5TY0-BGC | data/5T/5TY0-BGC/5TY0-BGC_ligand.pdbqt | data/5T/5TY0-BGC/5TY0-BGC_target.pdbqt | data/5T/5TY0-BGC/5TY0-BGC_decoys.pdbqt | data/5T/5TY0-BGC/5TY0-BGC_decoy_scores.csv |
5T9B-G3P | data/5T/5T9B-G3P/5T9B-G3P_ligand.pdbqt | data/5T/5T9B-G3P/5T9B-G3P_target.pdbqt | data/5T/5T9B-G3P/5T9B-G3P_decoys.pdbqt | data/5T/5T9B-G3P/5T9B-G3P_decoy_scores.csv |
5TM5-7EV | data/5T/5TM5-7EV/5TM5-7EV_ligand.pdbqt | data/5T/5TM5-7EV/5TM5-7EV_target.pdbqt | data/5T/5TM5-7EV/5TM5-7EV_decoys.pdbqt | data/5T/5TM5-7EV/5TM5-7EV_decoy_scores.csv |
5TO8-7FM | data/5T/5TO8-7FM/5TO8-7FM_ligand.pdbqt | data/5T/5TO8-7FM/5TO8-7FM_target.pdbqt | data/5T/5TO8-7FM/5TO8-7FM_decoys.pdbqt | data/5T/5TO8-7FM/5TO8-7FM_decoy_scores.csv |
5TLU-7EE | data/5T/5TLU-7EE/5TLU-7EE_ligand.pdbqt | data/5T/5TLU-7EE/5TLU-7EE_target.pdbqt | data/5T/5TLU-7EE/5TLU-7EE_decoys.pdbqt | data/5T/5TLU-7EE/5TLU-7EE_decoy_scores.csv |
5TL9-JZR | data/5T/5TL9-JZR/5TL9-JZR_ligand.pdbqt | data/5T/5TL9-JZR/5TL9-JZR_target.pdbqt | data/5T/5TL9-JZR/5TL9-JZR_decoys.pdbqt | data/5T/5TL9-JZR/5TL9-JZR_decoy_scores.csv |
5TKS-7DL | data/5T/5TKS-7DL/5TKS-7DL_ligand.pdbqt | data/5T/5TKS-7DL/5TKS-7DL_target.pdbqt | data/5T/5TKS-7DL/5TKS-7DL_decoys.pdbqt | data/5T/5TKS-7DL/5TKS-7DL_decoy_scores.csv |
5T5P-A2G | data/5T/5T5P-A2G/5T5P-A2G_ligand.pdbqt | data/5T/5T5P-A2G/5T5P-A2G_target.pdbqt | data/5T/5T5P-A2G/5T5P-A2G_decoys.pdbqt | data/5T/5T5P-A2G/5T5P-A2G_decoy_scores.csv |
5TEX-7AU | data/5T/5TEX-7AU/5TEX-7AU_ligand.pdbqt | data/5T/5TEX-7AU/5TEX-7AU_target.pdbqt | data/5T/5TEX-7AU/5TEX-7AU_decoys.pdbqt | data/5T/5TEX-7AU/5TEX-7AU_decoy_scores.csv |
5TCJ-79V | data/5T/5TCJ-79V/5TCJ-79V_ligand.pdbqt | data/5T/5TCJ-79V/5TCJ-79V_target.pdbqt | null | null |
5TOA-EST | data/5T/5TOA-EST/5TOA-EST_ligand.pdbqt | data/5T/5TOA-EST/5TOA-EST_target.pdbqt | data/5T/5TOA-EST/5TOA-EST_decoys.pdbqt | data/5T/5TOA-EST/5TOA-EST_decoy_scores.csv |
5T39-SAH | data/5T/5T39-SAH/5T39-SAH_ligand.pdbqt | data/5T/5T39-SAH/5T39-SAH_target.pdbqt | data/5T/5T39-SAH/5T39-SAH_decoys.pdbqt | data/5T/5T39-SAH/5T39-SAH_decoy_scores.csv |
5TIW-BCN | data/5T/5TIW-BCN/5TIW-BCN_ligand.pdbqt | data/5T/5TIW-BCN/5TIW-BCN_target.pdbqt | data/5T/5TIW-BCN/5TIW-BCN_decoys.pdbqt | data/5T/5TIW-BCN/5TIW-BCN_decoy_scores.csv |
5TN7-7G2 | data/5T/5TN7-7G2/5TN7-7G2_ligand.pdbqt | data/5T/5TN7-7G2/5TN7-7G2_target.pdbqt | data/5T/5TN7-7G2/5TN7-7G2_decoys.pdbqt | data/5T/5TN7-7G2/5TN7-7G2_decoy_scores.csv |
5TZW-7P4 | data/5T/5TZW-7P4/5TZW-7P4_ligand.pdbqt | data/5T/5TZW-7P4/5TZW-7P4_target.pdbqt | data/5T/5TZW-7P4/5TZW-7P4_decoys.pdbqt | data/5T/5TZW-7P4/5TZW-7P4_decoy_scores.csv |
5TBO-78Z | data/5T/5TBO-78Z/5TBO-78Z_ligand.pdbqt | data/5T/5TBO-78Z/5TBO-78Z_target.pdbqt | data/5T/5TBO-78Z/5TBO-78Z_decoys.pdbqt | data/5T/5TBO-78Z/5TBO-78Z_decoy_scores.csv |
5TZR-MK6 | data/5T/5TZR-MK6/5TZR-MK6_ligand.pdbqt | data/5T/5TZR-MK6/5TZR-MK6_target.pdbqt | data/5T/5TZR-MK6/5TZR-MK6_decoys.pdbqt | data/5T/5TZR-MK6/5TZR-MK6_decoy_scores.csv |
5TM8-7K6 | data/5T/5TM8-7K6/5TM8-7K6_ligand.pdbqt | data/5T/5TM8-7K6/5TM8-7K6_target.pdbqt | data/5T/5TM8-7K6/5TM8-7K6_decoys.pdbqt | data/5T/5TM8-7K6/5TM8-7K6_decoy_scores.csv |
5TBI-78V | data/5T/5TBI-78V/5TBI-78V_ligand.pdbqt | data/5T/5TBI-78V/5TBI-78V_target.pdbqt | data/5T/5TBI-78V/5TBI-78V_decoys.pdbqt | data/5T/5TBI-78V/5TBI-78V_decoy_scores.csv |
5THY-GDS | data/5T/5THY-GDS/5THY-GDS_ligand.pdbqt | data/5T/5THY-GDS/5THY-GDS_target.pdbqt | data/5T/5THY-GDS/5THY-GDS_decoys.pdbqt | data/5T/5THY-GDS/5THY-GDS_decoy_scores.csv |
5T91-BCN | data/5T/5T91-BCN/5T91-BCN_ligand.pdbqt | data/5T/5T91-BCN/5T91-BCN_target.pdbqt | data/5T/5T91-BCN/5T91-BCN_decoys.pdbqt | data/5T/5T91-BCN/5T91-BCN_decoy_scores.csv |
5TSU-LPI | data/5T/5TSU-LPI/5TSU-LPI_ligand.pdbqt | data/5T/5TSU-LPI/5TSU-LPI_target.pdbqt | data/5T/5TSU-LPI/5TSU-LPI_decoys.pdbqt | data/5T/5TSU-LPI/5TSU-LPI_decoy_scores.csv |
5TFZ-7BC | data/5T/5TFZ-7BC/5TFZ-7BC_ligand.pdbqt | data/5T/5TFZ-7BC/5TFZ-7BC_target.pdbqt | data/5T/5TFZ-7BC/5TFZ-7BC_decoys.pdbqt | data/5T/5TFZ-7BC/5TFZ-7BC_decoy_scores.csv |
5T7H-ZE7 | data/5T/5T7H-ZE7/5T7H-ZE7_ligand.pdbqt | data/5T/5T7H-ZE7/5T7H-ZE7_target.pdbqt | data/5T/5T7H-ZE7/5T7H-ZE7_decoys.pdbqt | data/5T/5T7H-ZE7/5T7H-ZE7_decoy_scores.csv |
5T9U-7HG | data/5T/5T9U-7HG/5T9U-7HG_ligand.pdbqt | data/5T/5T9U-7HG/5T9U-7HG_target.pdbqt | data/5T/5T9U-7HG/5T9U-7HG_decoys.pdbqt | data/5T/5T9U-7HG/5T9U-7HG_decoy_scores.csv |
5THU-GGG | data/5T/5THU-GGG/5THU-GGG_ligand.pdbqt | data/5T/5THU-GGG/5THU-GGG_target.pdbqt | data/5T/5THU-GGG/5THU-GGG_decoys.pdbqt | data/5T/5THU-GGG/5THU-GGG_decoy_scores.csv |
5TZH-7OP | data/5T/5TZH-7OP/5TZH-7OP_ligand.pdbqt | data/5T/5TZH-7OP/5TZH-7OP_target.pdbqt | data/5T/5TZH-7OP/5TZH-7OP_decoys.pdbqt | data/5T/5TZH-7OP/5TZH-7OP_decoy_scores.csv |
5TK3-13P | data/5T/5TK3-13P/5TK3-13P_ligand.pdbqt | data/5T/5TK3-13P/5TK3-13P_target.pdbqt | data/5T/5TK3-13P/5TK3-13P_decoys.pdbqt | data/5T/5TK3-13P/5TK3-13P_decoy_scores.csv |
5THY-SAH | data/5T/5THY-SAH/5THY-SAH_ligand.pdbqt | data/5T/5THY-SAH/5THY-SAH_target.pdbqt | data/5T/5THY-SAH/5THY-SAH_decoys.pdbqt | data/5T/5THY-SAH/5THY-SAH_decoy_scores.csv |
5TY2-NFF | data/5T/5TY2-NFF/5TY2-NFF_ligand.pdbqt | data/5T/5TY2-NFF/5TY2-NFF_target.pdbqt | data/5T/5TY2-NFF/5TY2-NFF_decoys.pdbqt | data/5T/5TY2-NFF/5TY2-NFF_decoy_scores.csv |
5TWJ-SAM | data/5T/5TWJ-SAM/5TWJ-SAM_ligand.pdbqt | data/5T/5TWJ-SAM/5TWJ-SAM_target.pdbqt | data/5T/5TWJ-SAM/5TWJ-SAM_decoys.pdbqt | data/5T/5TWJ-SAM/5TWJ-SAM_decoy_scores.csv |
5T3Q-75H | data/5T/5T3Q-75H/5T3Q-75H_ligand.pdbqt | data/5T/5T3Q-75H/5T3Q-75H_target.pdbqt | data/5T/5T3Q-75H/5T3Q-75H_decoys.pdbqt | data/5T/5T3Q-75H/5T3Q-75H_decoy_scores.csv |
5TYR-7O7 | data/5T/5TYR-7O7/5TYR-7O7_ligand.pdbqt | data/5T/5TYR-7O7/5TYR-7O7_target.pdbqt | data/5T/5TYR-7O7/5TYR-7O7_decoys.pdbqt | data/5T/5TYR-7O7/5TYR-7O7_decoy_scores.csv |
5T64-SAH | data/5T/5T64-SAH/5T64-SAH_ligand.pdbqt | data/5T/5T64-SAH/5T64-SAH_target.pdbqt | data/5T/5T64-SAH/5T64-SAH_decoys.pdbqt | data/5T/5T64-SAH/5T64-SAH_decoy_scores.csv |
5TA9-AAL | data/5T/5TA9-AAL/5TA9-AAL_ligand.pdbqt | data/5T/5TA9-AAL/5TA9-AAL_target.pdbqt | data/5T/5TA9-AAL/5TA9-AAL_decoys.pdbqt | data/5T/5TA9-AAL/5TA9-AAL_decoy_scores.csv |
5T7O-UMP | data/5T/5T7O-UMP/5T7O-UMP_ligand.pdbqt | data/5T/5T7O-UMP/5T7O-UMP_target.pdbqt | data/5T/5T7O-UMP/5T7O-UMP_decoys.pdbqt | data/5T/5T7O-UMP/5T7O-UMP_decoy_scores.csv |
5TCJ-P1T | data/5T/5TCJ-P1T/5TCJ-P1T_ligand.pdbqt | data/5T/5TCJ-P1T/5TCJ-P1T_target.pdbqt | null | null |
5TE2-7B9 | data/5T/5TE2-7B9/5TE2-7B9_ligand.pdbqt | data/5T/5TE2-7B9/5TE2-7B9_target.pdbqt | data/5T/5TE2-7B9/5TE2-7B9_decoys.pdbqt | data/5T/5TE2-7B9/5TE2-7B9_decoy_scores.csv |
5TU6-DST | data/5T/5TU6-DST/5TU6-DST_ligand.pdbqt | data/5T/5TU6-DST/5TU6-DST_target.pdbqt | data/5T/5TU6-DST/5TU6-DST_decoys.pdbqt | data/5T/5TU6-DST/5TU6-DST_decoy_scores.csv |
5TVJ-7LF | data/5T/5TVJ-7LF/5TVJ-7LF_ligand.pdbqt | data/5T/5TVJ-7LF/5TVJ-7LF_target.pdbqt | data/5T/5TVJ-7LF/5TVJ-7LF_decoys.pdbqt | data/5T/5TVJ-7LF/5TVJ-7LF_decoy_scores.csv |
5TOU-CYC | data/5T/5TOU-CYC/5TOU-CYC_ligand.pdbqt | data/5T/5TOU-CYC/5TOU-CYC_target.pdbqt | data/5T/5TOU-CYC/5TOU-CYC_decoys.pdbqt | data/5T/5TOU-CYC/5TOU-CYC_decoy_scores.csv |
5TN9-7EC | data/5T/5TN9-7EC/5TN9-7EC_ligand.pdbqt | data/5T/5TN9-7EC/5TN9-7EC_target.pdbqt | data/5T/5TN9-7EC/5TN9-7EC_decoys.pdbqt | data/5T/5TN9-7EC/5TN9-7EC_decoy_scores.csv |
5TV6-PML | data/5T/5TV6-PML/5TV6-PML_ligand.pdbqt | data/5T/5TV6-PML/5TV6-PML_target.pdbqt | data/5T/5TV6-PML/5TV6-PML_decoys.pdbqt | data/5T/5TV6-PML/5TV6-PML_decoy_scores.csv |
5TPA-7H2 | data/5T/5TPA-7H2/5TPA-7H2_ligand.pdbqt | data/5T/5TPA-7H2/5TPA-7H2_target.pdbqt | data/5T/5TPA-7H2/5TPA-7H2_decoys.pdbqt | data/5T/5TPA-7H2/5TPA-7H2_decoy_scores.csv |
5T2Z-017 | data/5T/5T2Z-017/5T2Z-017_ligand.pdbqt | data/5T/5T2Z-017/5T2Z-017_target.pdbqt | data/5T/5T2Z-017/5T2Z-017_decoys.pdbqt | data/5T/5T2Z-017/5T2Z-017_decoy_scores.csv |
5T8S-SAM | data/5T/5T8S-SAM/5T8S-SAM_ligand.pdbqt | data/5T/5T8S-SAM/5T8S-SAM_target.pdbqt | data/5T/5T8S-SAM/5T8S-SAM_decoys.pdbqt | data/5T/5T8S-SAM/5T8S-SAM_decoy_scores.csv |
5TQH-FLC | data/5T/5TQH-FLC/5TQH-FLC_ligand.pdbqt | data/5T/5TQH-FLC/5TQH-FLC_target.pdbqt | data/5T/5TQH-FLC/5TQH-FLC_decoys.pdbqt | data/5T/5TQH-FLC/5TQH-FLC_decoy_scores.csv |
5T1T-76P | data/5T/5T1T-76P/5T1T-76P_ligand.pdbqt | data/5T/5T1T-76P/5T1T-76P_target.pdbqt | data/5T/5T1T-76P/5T1T-76P_decoys.pdbqt | data/5T/5T1T-76P/5T1T-76P_decoy_scores.csv |
5TLZ-N26 | data/5T/5TLZ-N26/5TLZ-N26_ligand.pdbqt | data/5T/5TLZ-N26/5TLZ-N26_target.pdbqt | data/5T/5TLZ-N26/5TLZ-N26_decoys.pdbqt | data/5T/5TLZ-N26/5TLZ-N26_decoy_scores.csv |
5T6A-5GA | data/5T/5T6A-5GA/5T6A-5GA_ligand.pdbqt | data/5T/5T6A-5GA/5T6A-5GA_target.pdbqt | data/5T/5T6A-5GA/5T6A-5GA_decoys.pdbqt | data/5T/5T6A-5GA/5T6A-5GA_decoy_scores.csv |
5TWM-PE5 | data/5T/5TWM-PE5/5TWM-PE5_ligand.pdbqt | data/5T/5TWM-PE5/5TWM-PE5_target.pdbqt | data/5T/5TWM-PE5/5TWM-PE5_decoys.pdbqt | data/5T/5TWM-PE5/5TWM-PE5_decoy_scores.csv |
5T4K-76U | data/5T/5T4K-76U/5T4K-76U_ligand.pdbqt | data/5T/5T4K-76U/5T4K-76U_target.pdbqt | data/5T/5T4K-76U/5T4K-76U_decoys.pdbqt | data/5T/5T4K-76U/5T4K-76U_decoy_scores.csv |
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