Make OEIUPAC optional for normalize_molecule, cut release

choderalab / openmoltools

An open set of tools for automating tasks relating to small molecules

MIT License

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Closed Lnaden closed 6 years ago

Lnaden commented 6 years ago

Also fixed typo in the error messages for OEIUPAC which incorrectly told the user it was missing OEOmega

This is actually a critical bugfix for some users who have everything needed but IUPAC and its inhibiting some packages which depend on this package.

Lnaden commented 6 years ago

@jchodera do you think you can update the OpenEye License on here? I think it expired based on the logs.

jchodera commented 6 years ago

Will do!

Lnaden commented 6 years ago

Thanks!