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rdkit-rs / rdkit-sys Public

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Fork 6
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Add InChI Support#10

Open

benjysmith wants to merge 9 commits intordkit-rs:mainrdkit-rs/rdkit-sys:mainfrom

benjysmith:inchibenjysmith/rdkit-sys:inchiCopy head branch name to clipboard

Conversation Commits9 (9)Checks Files changed

Open

Add InChI Support#10
benjysmith wants to merge 9 commits intordkit-rs:mainfrom
benjysmith:inchi

Commits

Commits on Mar 19, 2023

Added initial InChI conversion and tests
benjysmith
committed
Separated InChI tests
benjysmith
committed
Shifted InChI functions to separate files
benjysmith
committed
Removed unnecessary includes
benjysmith
committed
Added inchi feature
benjysmith
committed
Added inchi_to_inchi_key
benjysmith
committed

Commits on Mar 20, 2023

Added end-of-file newlines
benjysmith
committed
Only link to RDInchiLib if inchi feature is enabled
benjysmith
committed
Added Benjamin Smith as author
benjysmith
committed

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