Metadata-Version: 2.4
Name: rdkit_buildutils
Version: 0.3.3
Summary: RDKit utilities for placeholder conversion, query matching, R-group decomposition, scaffold normalization, and ALT core providers
Author: Fabio Nelli
License: MIT License
        
        Copyright (c) 2025 Fabio Nelli
        
        Permission is hereby granted, free of charge, to any person obtaining a copy
        of this software and associated documentation files (the "Software"), to deal
        in the Software without restriction, including without limitation the rights
        to use, copy, modify, merge, publish, distribute, sublicense, and/or sell
        copies of the Software, and to permit persons to do so, subject to the
        following conditions:
        
        The above copyright notice and this permission notice shall be included in all
        copies or substantial portions of the Software.
        
        THE SOFTWARE IS PROVIDED "AS IS", WITHOUT WARRANTY OF ANY KIND, EXPRESS OR
        IMPLIED, INCLUDING BUT NOT LIMITED TO THE WARRANTIES OF MERCHANTABILITY,
        FITNESS FOR A PARTICULAR PURPOSE AND NONINFRINGEMENT. IN NO EVENT SHALL THE
        AUTHORS OR COPYRIGHT HOLDERS BE LIABLE FOR ANY CLAIM, DAMAGES OR OTHER
        LIABILITY, WHETHER IN AN ACTION OF CONTRACT, TORT OR OTHERWISE, ARISING FROM,
        OUT OF OR IN CONNECTION WITH THE SOFTWARE OR THE USE OR OTHER DEALINGS IN THE
        SOFTWARE.
        
Project-URL: Homepage, https://github.com/nelli-datascience/rdkit_buildutils
Project-URL: Issues, https://github.com/nelli-datascience/rdkit_buildutils/issues
Project-URL: Changelog, https://github.com/nelli-datascience/rdkit_buildutils/blob/main/CHANGELOG.md
Requires-Python: >=3.8
Description-Content-Type: text/markdown
License-File: LICENSE
Provides-Extra: pandas
Requires-Dist: pandas>=1.5; extra == "pandas"
Provides-Extra: db
Requires-Dist: sqlalchemy>=2.0; extra == "db"
Requires-Dist: psycopg2-binary>=2.9; extra == "db"
Provides-Extra: yaml
Requires-Dist: pyyaml>=6.0; extra == "yaml"
Dynamic: license-file

# rdkit_buildutils

Utilities built on top of RDKit for constructing, normalizing and decomposing molecules with placeholder substitution.
