Pinned Repositories
syn-retro-public
Syn-retro package is a python package that decomposes compounds with the defined reaction smarts and accessible building blocks. Users can easily integrate their own building blocks and RXN SMARTS to do retrosynthesis for their own scope.
synple-utils
Utility functions and helper functions for python scripts focus on cheminformatics.
Synple Chem's Repositories
Synple-Chem/synple-utils
Utility functions and helper functions for python scripts focus on cheminformatics.
Synple-Chem/syn-retro-public
Syn-retro package is a python package that decomposes compounds with the defined reaction smarts and accessible building blocks. Users can easily integrate their own building blocks and RXN SMARTS to do retrosynthesis for their own scope.