BenCree/rgroup_library_gen
Script that generates a library of Rgroups (with * atom) to be added using rgroups, tries to IUPAC name if it can, else the filename is just the smiles string
Python
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Script that generates a library of Rgroups (with * atom) to be added using rgroups, tries to IUPAC name if it can, else the filename is just the smiles string
Python
No one’s star this repository yet.