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 ⌀ |
|---|---|---|---|---|
2UZJ-E64 | data/2U/2UZJ-E64/2UZJ-E64_ligand.pdbqt | data/2U/2UZJ-E64/2UZJ-E64_target.pdbqt | data/2U/2UZJ-E64/2UZJ-E64_decoys.pdbqt | data/2U/2UZJ-E64/2UZJ-E64_decoy_scores.csv |
2UYY-NA7 | data/2U/2UYY-NA7/2UYY-NA7_ligand.pdbqt | data/2U/2UYY-NA7/2UYY-NA7_target.pdbqt | data/2U/2UYY-NA7/2UYY-NA7_decoys.pdbqt | data/2U/2UYY-NA7/2UYY-NA7_decoy_scores.csv |
2UX3-LDA | data/2U/2UX3-LDA/2UX3-LDA_ligand.pdbqt | data/2U/2UX3-LDA/2UX3-LDA_target.pdbqt | data/2U/2UX3-LDA/2UX3-LDA_decoys.pdbqt | data/2U/2UX3-LDA/2UX3-LDA_decoy_scores.csv |
2UXK-LDA | data/2U/2UXK-LDA/2UXK-LDA_ligand.pdbqt | data/2U/2UXK-LDA/2UXK-LDA_target.pdbqt | data/2U/2UXK-LDA/2UXK-LDA_decoys.pdbqt | data/2U/2UXK-LDA/2UXK-LDA_decoy_scores.csv |
2UW7-GVP | data/2U/2UW7-GVP/2UW7-GVP_ligand.pdbqt | data/2U/2UW7-GVP/2UW7-GVP_target.pdbqt | data/2U/2UW7-GVP/2UW7-GVP_decoys.pdbqt | data/2U/2UW7-GVP/2UW7-GVP_decoy_scores.csv |
2UZL-C94 | data/2U/2UZL-C94/2UZL-C94_ligand.pdbqt | data/2U/2UZL-C94/2UZL-C94_target.pdbqt | data/2U/2UZL-C94/2UZL-C94_decoys.pdbqt | data/2U/2UZL-C94/2UZL-C94_decoy_scores.csv |
2UUK-897 | data/2U/2UUK-897/2UUK-897_ligand.pdbqt | data/2U/2UUK-897/2UUK-897_target.pdbqt | data/2U/2UUK-897/2UUK-897_decoys.pdbqt | data/2U/2UUK-897/2UUK-897_decoy_scores.csv |
2UY4-AZM | data/2U/2UY4-AZM/2UY4-AZM_ligand.pdbqt | data/2U/2UY4-AZM/2UY4-AZM_target.pdbqt | data/2U/2UY4-AZM/2UY4-AZM_decoys.pdbqt | data/2U/2UY4-AZM/2UY4-AZM_decoy_scores.csv |
2UWU-SPO | data/2U/2UWU-SPO/2UWU-SPO_ligand.pdbqt | data/2U/2UWU-SPO/2UWU-SPO_target.pdbqt | data/2U/2UWU-SPO/2UWU-SPO_decoys.pdbqt | data/2U/2UWU-SPO/2UWU-SPO_decoy_scores.csv |
2UW0-GVK | data/2U/2UW0-GVK/2UW0-GVK_ligand.pdbqt | data/2U/2UW0-GVK/2UW0-GVK_target.pdbqt | data/2U/2UW0-GVK/2UW0-GVK_decoys.pdbqt | data/2U/2UW0-GVK/2UW0-GVK_decoy_scores.csv |
2UWU-LDA | data/2U/2UWU-LDA/2UWU-LDA_ligand.pdbqt | data/2U/2UWU-LDA/2UWU-LDA_target.pdbqt | data/2U/2UWU-LDA/2UWU-LDA_decoys.pdbqt | data/2U/2UWU-LDA/2UWU-LDA_decoy_scores.csv |
2UX3-UQ2 | data/2U/2UX3-UQ2/2UX3-UQ2_ligand.pdbqt | data/2U/2UX3-UQ2/2UX3-UQ2_target.pdbqt | data/2U/2UX3-UQ2/2UX3-UQ2_decoys.pdbqt | data/2U/2UX3-UQ2/2UX3-UQ2_decoy_scores.csv |
2UUJ-896 | data/2U/2UUJ-896/2UUJ-896_ligand.pdbqt | data/2U/2UUJ-896/2UUJ-896_target.pdbqt | data/2U/2UUJ-896/2UUJ-896_decoys.pdbqt | data/2U/2UUJ-896/2UUJ-896_decoy_scores.csv |
2UWW-SPO | data/2U/2UWW-SPO/2UWW-SPO_ligand.pdbqt | data/2U/2UWW-SPO/2UWW-SPO_target.pdbqt | data/2U/2UWW-SPO/2UWW-SPO_decoys.pdbqt | data/2U/2UWW-SPO/2UWW-SPO_decoy_scores.csv |
2UW5-GVN | data/2U/2UW5-GVN/2UW5-GVN_ligand.pdbqt | data/2U/2UW5-GVN/2UW5-GVN_target.pdbqt | data/2U/2UW5-GVN/2UW5-GVN_decoys.pdbqt | data/2U/2UW5-GVN/2UW5-GVN_decoy_scores.csv |
2UUP-LK4 | data/2U/2UUP-LK4/2UUP-LK4_ligand.pdbqt | data/2U/2UUP-LK4/2UUP-LK4_target.pdbqt | data/2U/2UUP-LK4/2UUP-LK4_decoys.pdbqt | data/2U/2UUP-LK4/2UUP-LK4_decoy_scores.csv |
2UZ3-TTP | data/2U/2UZ3-TTP/2UZ3-TTP_ligand.pdbqt | data/2U/2UZ3-TTP/2UZ3-TTP_target.pdbqt | data/2U/2UZ3-TTP/2UZ3-TTP_decoys.pdbqt | data/2U/2UZ3-TTP/2UZ3-TTP_decoy_scores.csv |
2UWW-HTO | data/2U/2UWW-HTO/2UWW-HTO_ligand.pdbqt | data/2U/2UWW-HTO/2UWW-HTO_target.pdbqt | data/2U/2UWW-HTO/2UWW-HTO_decoys.pdbqt | data/2U/2UWW-HTO/2UWW-HTO_decoy_scores.csv |
2UX5-UQ2 | data/2U/2UX5-UQ2/2UX5-UQ2_ligand.pdbqt | data/2U/2UX5-UQ2/2UX5-UQ2_target.pdbqt | data/2U/2UX5-UQ2/2UX5-UQ2_decoys.pdbqt | data/2U/2UX5-UQ2/2UX5-UQ2_decoy_scores.csv |
2UAG-ADP | data/2U/2UAG-ADP/2UAG-ADP_ligand.pdbqt | data/2U/2UAG-ADP/2UAG-ADP_target.pdbqt | data/2U/2UAG-ADP/2UAG-ADP_decoys.pdbqt | data/2U/2UAG-ADP/2UAG-ADP_decoy_scores.csv |
2UDP-UPP | data/2U/2UDP-UPP/2UDP-UPP_ligand.pdbqt | data/2U/2UDP-UPP/2UDP-UPP_target.pdbqt | data/2U/2UDP-UPP/2UDP-UPP_decoys.pdbqt | data/2U/2UDP-UPP/2UDP-UPP_decoy_scores.csv |
2UUI-PLM | data/2U/2UUI-PLM/2UUI-PLM_ligand.pdbqt | data/2U/2UUI-PLM/2UUI-PLM_target.pdbqt | data/2U/2UUI-PLM/2UUI-PLM_decoys.pdbqt | data/2U/2UUI-PLM/2UUI-PLM_decoy_scores.csv |
2UX5-SPO | data/2U/2UX5-SPO/2UX5-SPO_ligand.pdbqt | data/2U/2UX5-SPO/2UX5-SPO_target.pdbqt | data/2U/2UX5-SPO/2UX5-SPO_decoys.pdbqt | data/2U/2UX5-SPO/2UX5-SPO_decoy_scores.csv |
2UWV-UQ2 | data/2U/2UWV-UQ2/2UWV-UQ2_ligand.pdbqt | data/2U/2UWV-UQ2/2UWV-UQ2_target.pdbqt | data/2U/2UWV-UQ2/2UWV-UQ2_decoys.pdbqt | data/2U/2UWV-UQ2/2UWV-UQ2_decoy_scores.csv |
2UZN-C96 | data/2U/2UZN-C96/2UZN-C96_ligand.pdbqt | data/2U/2UZN-C96/2UZN-C96_target.pdbqt | data/2U/2UZN-C96/2UZN-C96_decoys.pdbqt | data/2U/2UZN-C96/2UZN-C96_decoy_scores.csv |
2UV5-AMZ | data/2U/2UV5-AMZ/2UV5-AMZ_ligand.pdbqt | data/2U/2UV5-AMZ/2UV5-AMZ_target.pdbqt | data/2U/2UV5-AMZ/2UV5-AMZ_decoys.pdbqt | data/2U/2UV5-AMZ/2UV5-AMZ_decoy_scores.csv |
2UXI-G50 | data/2U/2UXI-G50/2UXI-G50_ligand.pdbqt | data/2U/2UXI-G50/2UXI-G50_target.pdbqt | data/2U/2UXI-G50/2UXI-G50_decoys.pdbqt | data/2U/2UXI-G50/2UXI-G50_decoy_scores.csv |
2UXR-ICT | data/2U/2UXR-ICT/2UXR-ICT_ligand.pdbqt | data/2U/2UXR-ICT/2UXR-ICT_target.pdbqt | data/2U/2UXR-ICT/2UXR-ICT_decoys.pdbqt | data/2U/2UXR-ICT/2UXR-ICT_decoy_scores.csv |
2UVM-GVF | data/2U/2UVM-GVF/2UVM-GVF_ligand.pdbqt | data/2U/2UVM-GVF/2UVM-GVF_target.pdbqt | data/2U/2UVM-GVF/2UVM-GVF_decoys.pdbqt | data/2U/2UVM-GVF/2UVM-GVF_decoy_scores.csv |
2UKD-C5P | data/2U/2UKD-C5P/2UKD-C5P_ligand.pdbqt | data/2U/2UKD-C5P/2UKD-C5P_target.pdbqt | data/2U/2UKD-C5P/2UKD-C5P_decoys.pdbqt | data/2U/2UKD-C5P/2UKD-C5P_decoy_scores.csv |
2UXK-HTO | data/2U/2UXK-HTO/2UXK-HTO_ligand.pdbqt | data/2U/2UXK-HTO/2UXK-HTO_target.pdbqt | data/2U/2UXK-HTO/2UXK-HTO_decoys.pdbqt | data/2U/2UXK-HTO/2UXK-HTO_decoy_scores.csv |
2UUH-PAM | data/2U/2UUH-PAM/2UUH-PAM_ligand.pdbqt | data/2U/2UUH-PAM/2UUH-PAM_target.pdbqt | data/2U/2UUH-PAM/2UUH-PAM_decoys.pdbqt | data/2U/2UUH-PAM/2UUH-PAM_decoy_scores.csv |
2USN-IN8 | data/2U/2USN-IN8/2USN-IN8_ligand.pdbqt | data/2U/2USN-IN8/2USN-IN8_target.pdbqt | data/2U/2USN-IN8/2USN-IN8_decoys.pdbqt | data/2U/2USN-IN8/2USN-IN8_decoy_scores.csv |
2UWT-UQ2 | data/2U/2UWT-UQ2/2UWT-UQ2_ligand.pdbqt | data/2U/2UWT-UQ2/2UWT-UQ2_target.pdbqt | data/2U/2UWT-UQ2/2UWT-UQ2_decoys.pdbqt | data/2U/2UWT-UQ2/2UWT-UQ2_decoy_scores.csv |
2UUO-LK3 | data/2U/2UUO-LK3/2UUO-LK3_ligand.pdbqt | data/2U/2UUO-LK3/2UUO-LK3_target.pdbqt | data/2U/2UUO-LK3/2UUO-LK3_decoys.pdbqt | data/2U/2UUO-LK3/2UUO-LK3_decoy_scores.csv |
2UVZ-GVJ | data/2U/2UVZ-GVJ/2UVZ-GVJ_ligand.pdbqt | data/2U/2UVZ-GVJ/2UVZ-GVJ_target.pdbqt | data/2U/2UVZ-GVJ/2UVZ-GVJ_decoys.pdbqt | data/2U/2UVZ-GVJ/2UVZ-GVJ_decoy_scores.csv |
2UXJ-LDA | data/2U/2UXJ-LDA/2UXJ-LDA_ligand.pdbqt | data/2U/2UXJ-LDA/2UXJ-LDA_target.pdbqt | data/2U/2UXJ-LDA/2UXJ-LDA_decoys.pdbqt | data/2U/2UXJ-LDA/2UXJ-LDA_decoy_scores.csv |
2UXU-NAR | data/2U/2UXU-NAR/2UXU-NAR_ligand.pdbqt | data/2U/2UXU-NAR/2UXU-NAR_target.pdbqt | data/2U/2UXU-NAR/2UXU-NAR_decoys.pdbqt | data/2U/2UXU-NAR/2UXU-NAR_decoy_scores.csv |
2UX3-HTO | data/2U/2UX3-HTO/2UX3-HTO_ligand.pdbqt | data/2U/2UX3-HTO/2UX3-HTO_target.pdbqt | data/2U/2UX3-HTO/2UX3-HTO_decoys.pdbqt | data/2U/2UX3-HTO/2UX3-HTO_decoy_scores.csv |
2UYM-K03 | data/2U/2UYM-K03/2UYM-K03_ligand.pdbqt | data/2U/2UYM-K03/2UYM-K03_target.pdbqt | data/2U/2UYM-K03/2UYM-K03_decoys.pdbqt | data/2U/2UYM-K03/2UYM-K03_decoy_scores.csv |
2UWT-SPO | data/2U/2UWT-SPO/2UWT-SPO_ligand.pdbqt | data/2U/2UWT-SPO/2UWT-SPO_target.pdbqt | data/2U/2UWT-SPO/2UWT-SPO_decoys.pdbqt | data/2U/2UWT-SPO/2UWT-SPO_decoy_scores.csv |
2UWP-894 | data/2U/2UWP-894/2UWP-894_ligand.pdbqt | data/2U/2UWP-894/2UWP-894_target.pdbqt | data/2U/2UWP-894/2UWP-894_decoys.pdbqt | data/2U/2UWP-894/2UWP-894_decoy_scores.csv |
2UVO-NDG | data/2U/2UVO-NDG/2UVO-NDG_ligand.pdbqt | data/2U/2UVO-NDG/2UVO-NDG_target.pdbqt | data/2U/2UVO-NDG/2UVO-NDG_decoys.pdbqt | data/2U/2UVO-NDG/2UVO-NDG_decoy_scores.csv |
2UZH-CDP | data/2U/2UZH-CDP/2UZH-CDP_ligand.pdbqt | data/2U/2UZH-CDP/2UZH-CDP_target.pdbqt | data/2U/2UZH-CDP/2UZH-CDP_decoys.pdbqt | data/2U/2UZH-CDP/2UZH-CDP_decoy_scores.csv |
2UYT-ADP | data/2U/2UYT-ADP/2UYT-ADP_ligand.pdbqt | data/2U/2UYT-ADP/2UYT-ADP_target.pdbqt | data/2U/2UYT-ADP/2UYT-ADP_decoys.pdbqt | data/2U/2UYT-ADP/2UYT-ADP_decoy_scores.csv |
2UUH-PLM | data/2U/2UUH-PLM/2UUH-PLM_ligand.pdbqt | data/2U/2UUH-PLM/2UUH-PLM_target.pdbqt | data/2U/2UUH-PLM/2UUH-PLM_decoys.pdbqt | data/2U/2UUH-PLM/2UUH-PLM_decoy_scores.csv |
2UZ2-BTN | data/2U/2UZ2-BTN/2UZ2-BTN_ligand.pdbqt | data/2U/2UZ2-BTN/2UZ2-BTN_target.pdbqt | data/2U/2UZ2-BTN/2UZ2-BTN_decoys.pdbqt | data/2U/2UZ2-BTN/2UZ2-BTN_decoy_scores.csv |
2UXA-GLU | data/2U/2UXA-GLU/2UXA-GLU_ligand.pdbqt | data/2U/2UXA-GLU/2UXA-GLU_target.pdbqt | data/2U/2UXA-GLU/2UXA-GLU_decoys.pdbqt | data/2U/2UXA-GLU/2UXA-GLU_decoy_scores.csv |
2UUE-MTZ | data/2U/2UUE-MTZ/2UUE-MTZ_ligand.pdbqt | data/2U/2UUE-MTZ/2UUE-MTZ_target.pdbqt | data/2U/2UUE-MTZ/2UUE-MTZ_decoys.pdbqt | data/2U/2UUE-MTZ/2UUE-MTZ_decoy_scores.csv |
2UYM-ADP | data/2U/2UYM-ADP/2UYM-ADP_ligand.pdbqt | data/2U/2UYM-ADP/2UYM-ADP_target.pdbqt | data/2U/2UYM-ADP/2UYM-ADP_decoys.pdbqt | data/2U/2UYM-ADP/2UYM-ADP_decoy_scores.csv |
2UX3-SPO | data/2U/2UX3-SPO/2UX3-SPO_ligand.pdbqt | data/2U/2UX3-SPO/2UX3-SPO_target.pdbqt | data/2U/2UX3-SPO/2UX3-SPO_decoys.pdbqt | data/2U/2UX3-SPO/2UX3-SPO_decoy_scores.csv |
2UX5-LDA | data/2U/2UX5-LDA/2UX5-LDA_ligand.pdbqt | data/2U/2UX5-LDA/2UX5-LDA_target.pdbqt | data/2U/2UX5-LDA/2UX5-LDA_decoys.pdbqt | data/2U/2UX5-LDA/2UX5-LDA_decoy_scores.csv |
2UUH-LMU | data/2U/2UUH-LMU/2UUH-LMU_ligand.pdbqt | data/2U/2UUH-LMU/2UUH-LMU_target.pdbqt | data/2U/2UUH-LMU/2UUH-LMU_decoys.pdbqt | data/2U/2UUH-LMU/2UUH-LMU_decoy_scores.csv |
2UY5-H35 | data/2U/2UY5-H35/2UY5-H35_ligand.pdbqt | data/2U/2UY5-H35/2UY5-H35_target.pdbqt | data/2U/2UY5-H35/2UY5-H35_decoys.pdbqt | data/2U/2UY5-H35/2UY5-H35_decoy_scores.csv |
2UYI-ADP | data/2U/2UYI-ADP/2UYI-ADP_ligand.pdbqt | data/2U/2UYI-ADP/2UYI-ADP_target.pdbqt | data/2U/2UYI-ADP/2UYI-ADP_decoys.pdbqt | data/2U/2UYI-ADP/2UYI-ADP_decoy_scores.csv |
2UZE-C95 | data/2U/2UZE-C95/2UZE-C95_ligand.pdbqt | data/2U/2UZE-C95/2UZE-C95_target.pdbqt | data/2U/2UZE-C95/2UZE-C95_decoys.pdbqt | data/2U/2UZE-C95/2UZE-C95_decoy_scores.csv |
2UWV-SPO | data/2U/2UWV-SPO/2UWV-SPO_ligand.pdbqt | data/2U/2UWV-SPO/2UWV-SPO_target.pdbqt | data/2U/2UWV-SPO/2UWV-SPO_decoys.pdbqt | data/2U/2UWV-SPO/2UWV-SPO_decoy_scores.csv |
2UYW-BTN | data/2U/2UYW-BTN/2UYW-BTN_ligand.pdbqt | data/2U/2UYW-BTN/2UYW-BTN_target.pdbqt | data/2U/2UYW-BTN/2UYW-BTN_decoys.pdbqt | data/2U/2UYW-BTN/2UYW-BTN_decoy_scores.csv |
2UXK-UQ2 | data/2U/2UXK-UQ2/2UXK-UQ2_ligand.pdbqt | data/2U/2UXK-UQ2/2UXK-UQ2_target.pdbqt | data/2U/2UXK-UQ2/2UXK-UQ2_decoys.pdbqt | data/2U/2UXK-UQ2/2UXK-UQ2_decoy_scores.csv |
2UZV-SS5 | data/2U/2UZV-SS5/2UZV-SS5_ligand.pdbqt | data/2U/2UZV-SS5/2UZV-SS5_target.pdbqt | data/2U/2UZV-SS5/2UZV-SS5_decoys.pdbqt | data/2U/2UZV-SS5/2UZV-SS5_decoy_scores.csv |
2UWW-LDA | data/2U/2UWW-LDA/2UWW-LDA_ligand.pdbqt | data/2U/2UWW-LDA/2UWW-LDA_target.pdbqt | data/2U/2UWW-LDA/2UWW-LDA_decoys.pdbqt | data/2U/2UWW-LDA/2UWW-LDA_decoy_scores.csv |
2UWU-UQ2 | data/2U/2UWU-UQ2/2UWU-UQ2_ligand.pdbqt | data/2U/2UWU-UQ2/2UWU-UQ2_target.pdbqt | data/2U/2UWU-UQ2/2UWU-UQ2_decoys.pdbqt | data/2U/2UWU-UQ2/2UWU-UQ2_decoy_scores.csv |
2UXK-SPO | data/2U/2UXK-SPO/2UXK-SPO_ligand.pdbqt | data/2U/2UXK-SPO/2UXK-SPO_target.pdbqt | data/2U/2UXK-SPO/2UXK-SPO_decoys.pdbqt | data/2U/2UXK-SPO/2UXK-SPO_decoy_scores.csv |
2UWT-LDA | data/2U/2UWT-LDA/2UWT-LDA_ligand.pdbqt | data/2U/2UWT-LDA/2UWT-LDA_target.pdbqt | data/2U/2UWT-LDA/2UWT-LDA_decoys.pdbqt | data/2U/2UWT-LDA/2UWT-LDA_decoy_scores.csv |
2UZO-C62 | data/2U/2UZO-C62/2UZO-C62_ligand.pdbqt | data/2U/2UZO-C62/2UZO-C62_target.pdbqt | data/2U/2UZO-C62/2UZO-C62_decoys.pdbqt | data/2U/2UZO-C62/2UZO-C62_decoy_scores.csv |
2UVY-GVI | data/2U/2UVY-GVI/2UVY-GVI_ligand.pdbqt | data/2U/2UVY-GVI/2UVY-GVI_target.pdbqt | data/2U/2UVY-GVI/2UVY-GVI_decoys.pdbqt | data/2U/2UVY-GVI/2UVY-GVI_decoy_scores.csv |
2UX9-FMN | data/2U/2UX9-FMN/2UX9-FMN_ligand.pdbqt | data/2U/2UX9-FMN/2UX9-FMN_target.pdbqt | data/2U/2UX9-FMN/2UX9-FMN_decoys.pdbqt | data/2U/2UX9-FMN/2UX9-FMN_decoy_scores.csv |
2UV0-OHN | data/2U/2UV0-OHN/2UV0-OHN_ligand.pdbqt | data/2U/2UV0-OHN/2UV0-OHN_target.pdbqt | data/2U/2UV0-OHN/2UV0-OHN_decoys.pdbqt | data/2U/2UV0-OHN/2UV0-OHN_decoy_scores.csv |
2UZA-HTL | data/2U/2UZA-HTL/2UZA-HTL_ligand.pdbqt | data/2U/2UZA-HTL/2UZA-HTL_target.pdbqt | data/2U/2UZA-HTL/2UZA-HTL_decoys.pdbqt | data/2U/2UZA-HTL/2UZA-HTL_decoy_scores.csv |
2UW1-GVM | data/2U/2UW1-GVM/2UW1-GVM_ligand.pdbqt | data/2U/2UW1-GVM/2UW1-GVM_target.pdbqt | data/2U/2UW1-GVM/2UW1-GVM_decoys.pdbqt | data/2U/2UW1-GVM/2UW1-GVM_decoy_scores.csv |
2UXH-QUE | data/2U/2UXH-QUE/2UXH-QUE_ligand.pdbqt | data/2U/2UXH-QUE/2UXH-QUE_target.pdbqt | data/2U/2UXH-QUE/2UXH-QUE_decoys.pdbqt | data/2U/2UXH-QUE/2UXH-QUE_decoy_scores.csv |
2UV4-AMP | data/2U/2UV4-AMP/2UV4-AMP_ligand.pdbqt | data/2U/2UV4-AMP/2UV4-AMP_target.pdbqt | data/2U/2UV4-AMP/2UV4-AMP_decoys.pdbqt | data/2U/2UV4-AMP/2UV4-AMP_decoy_scores.csv |
2UWL-895 | data/2U/2UWL-895/2UWL-895_ligand.pdbqt | data/2U/2UWL-895/2UWL-895_target.pdbqt | data/2U/2UWL-895/2UWL-895_decoys.pdbqt | data/2U/2UWL-895/2UWL-895_decoy_scores.csv |
2UW6-GVO | data/2U/2UW6-GVO/2UW6-GVO_ligand.pdbqt | data/2U/2UW6-GVO/2UW6-GVO_target.pdbqt | data/2U/2UW6-GVO/2UW6-GVO_decoys.pdbqt | data/2U/2UW6-GVO/2UW6-GVO_decoy_scores.csv |
2UUI-LMT | data/2U/2UUI-LMT/2UUI-LMT_ligand.pdbqt | data/2U/2UUI-LMT/2UUI-LMT_target.pdbqt | data/2U/2UUI-LMT/2UUI-LMT_decoys.pdbqt | data/2U/2UUI-LMT/2UUI-LMT_decoy_scores.csv |
2UZI-GTP | data/2U/2UZI-GTP/2UZI-GTP_ligand.pdbqt | data/2U/2UZI-GTP/2UZI-GTP_target.pdbqt | data/2U/2UZI-GTP/2UZI-GTP_decoys.pdbqt | data/2U/2UZI-GTP/2UZI-GTP_decoy_scores.csv |
2UZ9-XAN | data/2U/2UZ9-XAN/2UZ9-XAN_ligand.pdbqt | data/2U/2UZ9-XAN/2UZ9-XAN_target.pdbqt | data/2U/2UZ9-XAN/2UZ9-XAN_decoys.pdbqt | data/2U/2UZ9-XAN/2UZ9-XAN_decoy_scores.csv |
2UWT-HTO | data/2U/2UWT-HTO/2UWT-HTO_ligand.pdbqt | data/2U/2UWT-HTO/2UWT-HTO_target.pdbqt | data/2U/2UWT-HTO/2UWT-HTO_decoys.pdbqt | data/2U/2UWT-HTO/2UWT-HTO_decoy_scores.csv |
2UWD-2GG | data/2U/2UWD-2GG/2UWD-2GG_ligand.pdbqt | data/2U/2UWD-2GG/2UWD-2GG_target.pdbqt | data/2U/2UWD-2GG/2UWD-2GG_decoys.pdbqt | data/2U/2UWD-2GG/2UWD-2GG_decoy_scores.csv |
2UX5-HTO | data/2U/2UX5-HTO/2UX5-HTO_ligand.pdbqt | data/2U/2UX5-HTO/2UX5-HTO_target.pdbqt | data/2U/2UX5-HTO/2UX5-HTO_decoys.pdbqt | data/2U/2UX5-HTO/2UX5-HTO_decoy_scores.csv |
2UYQ-SAM | data/2U/2UYQ-SAM/2UYQ-SAM_ligand.pdbqt | data/2U/2UYQ-SAM/2UYQ-SAM_target.pdbqt | data/2U/2UYQ-SAM/2UYQ-SAM_decoys.pdbqt | data/2U/2UYQ-SAM/2UYQ-SAM_decoy_scores.csv |
2UW8-GVQ | data/2U/2UW8-GVQ/2UW8-GVQ_ligand.pdbqt | data/2U/2UW8-GVQ/2UW8-GVQ_target.pdbqt | data/2U/2UW8-GVQ/2UW8-GVQ_decoys.pdbqt | data/2U/2UW8-GVQ/2UW8-GVQ_decoy_scores.csv |
2UXJ-HTO | data/2U/2UXJ-HTO/2UXJ-HTO_ligand.pdbqt | data/2U/2UXJ-HTO/2UXJ-HTO_target.pdbqt | data/2U/2UXJ-HTO/2UXJ-HTO_decoys.pdbqt | data/2U/2UXJ-HTO/2UXJ-HTO_decoy_scores.csv |
2UV7-AMP | data/2U/2UV7-AMP/2UV7-AMP_ligand.pdbqt | data/2U/2UV7-AMP/2UV7-AMP_target.pdbqt | data/2U/2UV7-AMP/2UV7-AMP_decoys.pdbqt | data/2U/2UV7-AMP/2UV7-AMP_decoy_scores.csv |
2UWV-HTO | data/2U/2UWV-HTO/2UWV-HTO_ligand.pdbqt | data/2U/2UWV-HTO/2UWV-HTO_target.pdbqt | data/2U/2UWV-HTO/2UWV-HTO_decoys.pdbqt | data/2U/2UWV-HTO/2UWV-HTO_decoy_scores.csv |
2UZH-IPE | data/2U/2UZH-IPE/2UZH-IPE_ligand.pdbqt | data/2U/2UZH-IPE/2UZH-IPE_target.pdbqt | data/2U/2UZH-IPE/2UZH-IPE_decoys.pdbqt | data/2U/2UZH-IPE/2UZH-IPE_decoy_scores.csv |
2UYT-LRH | data/2U/2UYT-LRH/2UYT-LRH_ligand.pdbqt | data/2U/2UYT-LRH/2UYT-LRH_target.pdbqt | data/2U/2UYT-LRH/2UYT-LRH_decoys.pdbqt | data/2U/2UYT-LRH/2UYT-LRH_decoy_scores.csv |
2UDP-NAD | data/2U/2UDP-NAD/2UDP-NAD_ligand.pdbqt | data/2U/2UDP-NAD/2UDP-NAD_target.pdbqt | data/2U/2UDP-NAD/2UDP-NAD_decoys.pdbqt | data/2U/2UDP-NAD/2UDP-NAD_decoy_scores.csv |
2UWV-LDA | data/2U/2UWV-LDA/2UWV-LDA_ligand.pdbqt | data/2U/2UWV-LDA/2UWV-LDA_target.pdbqt | data/2U/2UWV-LDA/2UWV-LDA_decoys.pdbqt | data/2U/2UWV-LDA/2UWV-LDA_decoy_scores.csv |
2UYI-K02 | data/2U/2UYI-K02/2UYI-K02_ligand.pdbqt | data/2U/2UYI-K02/2UYI-K02_target.pdbqt | data/2U/2UYI-K02/2UYI-K02_decoys.pdbqt | data/2U/2UYI-K02/2UYI-K02_decoy_scores.csv |
2UXJ-SPO | data/2U/2UXJ-SPO/2UXJ-SPO_ligand.pdbqt | data/2U/2UXJ-SPO/2UXJ-SPO_target.pdbqt | data/2U/2UXJ-SPO/2UXJ-SPO_decoys.pdbqt | data/2U/2UXJ-SPO/2UXJ-SPO_decoy_scores.csv |
2UUV-PL3 | data/2U/2UUV-PL3/2UUV-PL3_ligand.pdbqt | data/2U/2UUV-PL3/2UUV-PL3_target.pdbqt | data/2U/2UUV-PL3/2UUV-PL3_decoys.pdbqt | data/2U/2UUV-PL3/2UUV-PL3_decoy_scores.csv |
2UZS-4IP | data/2U/2UZS-4IP/2UZS-4IP_ligand.pdbqt | data/2U/2UZS-4IP/2UZS-4IP_target.pdbqt | data/2U/2UZS-4IP/2UZS-4IP_decoys.pdbqt | data/2U/2UZS-4IP/2UZS-4IP_decoy_scores.csv |
2UWW-UQ2 | data/2U/2UWW-UQ2/2UWW-UQ2_ligand.pdbqt | data/2U/2UWW-UQ2/2UWW-UQ2_target.pdbqt | data/2U/2UWW-UQ2/2UWW-UQ2_decoys.pdbqt | data/2U/2UWW-UQ2/2UWW-UQ2_decoy_scores.csv |
2UV2-GVD | data/2U/2UV2-GVD/2UV2-GVD_ligand.pdbqt | data/2U/2UV2-GVD/2UV2-GVD_target.pdbqt | data/2U/2UV2-GVD/2UV2-GVD_decoys.pdbqt | data/2U/2UV2-GVD/2UV2-GVD_decoy_scores.csv |
2UY3-H33 | data/2U/2UY3-H33/2UY3-H33_ligand.pdbqt | data/2U/2UY3-H33/2UY3-H33_target.pdbqt | data/2U/2UY3-H33/2UY3-H33_decoys.pdbqt | data/2U/2UY3-H33/2UY3-H33_decoy_scores.csv |
2UWO-701 | data/2U/2UWO-701/2UWO-701_ligand.pdbqt | data/2U/2UWO-701/2UWO-701_target.pdbqt | data/2U/2UWO-701/2UWO-701_decoys.pdbqt | data/2U/2UWO-701/2UWO-701_decoy_scores.csv |
10GS-VWW | data/10/10GS-VWW/10GS-VWW_ligand.pdbqt | data/10/10GS-VWW/10GS-VWW_target.pdbqt | data/10/10GS-VWW/10GS-VWW_decoys.pdbqt | data/10/10GS-VWW/10GS-VWW_decoy_scores.csv |
3IN1-ADP | data/3I/3IN1-ADP/3IN1-ADP_ligand.pdbqt | data/3I/3IN1-ADP/3IN1-ADP_target.pdbqt | data/3I/3IN1-ADP/3IN1-ADP_decoys.pdbqt | data/3I/3IN1-ADP/3IN1-ADP_decoy_scores.csv |
3IC3-BGC | data/3I/3IC3-BGC/3IC3-BGC_ligand.pdbqt | data/3I/3IC3-BGC/3IC3-BGC_target.pdbqt | data/3I/3IC3-BGC/3IC3-BGC_decoys.pdbqt | data/3I/3IC3-BGC/3IC3-BGC_decoy_scores.csv |
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