fragalysis.widgets.ligand_cif
Module Contents
Functions
UI for downloading targets from fragalysis |
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Create widgets to create a ligand CIF file |
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widgets to request target download |
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API
- fragalysis.widgets.ligand_cif.ligand_cif()
UI for downloading targets from fragalysis
- fragalysis.widgets.ligand_cif._cif_ui_1()
Create widgets to create a ligand CIF file
- fragalysis.widgets.ligand_cif._cif_ui_2(ui_main, dir: str = '.')
widgets to request target download
- fragalysis.widgets.ligand_cif._cif_ui_3(ui_main, pdb: pathlib.Path, output)
- fragalysis.widgets.ligand_cif.create_cif(cif: pathlib.Path, smiles: str, res)