All modules for which code is available
- smartclass.chem.classification.bfs_search_classes_generator
- smartclass.chem.classification.get_class_structures
- smartclass.chem.classification.search_class
- smartclass.chem.classification.search_classes
- smartclass.chem.conversion.convert_inchi_to_inchikey
- smartclass.chem.conversion.convert_inchi_to_mass
- smartclass.chem.conversion.convert_inchi_to_mol
- smartclass.chem.conversion.convert_inchi_to_smiles
- smartclass.chem.conversion.convert_mol_to_cxsmiles
- smartclass.chem.conversion.convert_mol_to_inchi
- smartclass.chem.conversion.convert_mol_to_inchikey
- smartclass.chem.conversion.convert_mol_to_smarts
- smartclass.chem.conversion.convert_mol_to_smiles
- smartclass.chem.conversion.convert_molblock_to_mol
- smartclass.chem.conversion.convert_smarts_to_mol
- smartclass.chem.conversion.convert_smiles_to_canonical_smiles
- smartclass.chem.conversion.convert_smiles_to_formula
- smartclass.chem.conversion.convert_smiles_to_inchi
- smartclass.chem.conversion.convert_smiles_to_mass
- smartclass.chem.conversion.convert_smiles_to_mol
- smartclass.chem.helpers.check_missing_stereochemistry
- smartclass.chem.helpers.enumerate_structures
- smartclass.chem.helpers.fix_inchi_tautomerization
- smartclass.chem.helpers.get_num_atoms_bonds
- smartclass.chem.helpers.get_num_matched_atoms_bonds
- smartclass.chem.helpers.standardize
- smartclass.chem.similarity.calculate_mcs
- smartclass.helpers.check_smiles_contains_no_dot
- smartclass.helpers.check_smiles_contains_no_isotope
- smartclass.helpers.check_smiles_isomeric
- smartclass.helpers.combine_csv_files
- smartclass.helpers.convert_chemical_formula
- smartclass.helpers.convert_classyfire_dict
- smartclass.helpers.convert_list_of_dict
- smartclass.helpers.download_file_if_not_exists
- smartclass.helpers.get_request
- smartclass.helpers.read_query
- smartclass.helpers.sample_list
- smartclass.helpers.split_csv
- smartclass.io.export_dict_to_json
- smartclass.io.export_results
- smartclass.io.load_csv_from_path
- smartclass.io.load_external_classes_file
- smartclass.io.load_json_from_path
- smartclass.io.load_json_from_url
- smartclass.io.load_json_from_url_or_path
- smartclass.io.load_pkg_bitter_smiles
- smartclass.io.load_pkg_chemical_hierarchy
- smartclass.io.load_pkg_classes
- smartclass.io.load_pkg_data
- smartclass.io.load_pkg_file
- smartclass.io.load_pkg_mappings
- smartclass.io.load_pkg_mia
- smartclass.io.load_smiles
- smartclass.io.load_tsv_from_path