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schrodinger / coordgenlibs

Schrodinger-developed 2D Coordinate Generation
BSD 3-Clause "New" or "Revised" License
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remove chirality and pseudo-chirality (s_st_Chirality and s_st_AtomNumChirality) tags #47

Closed greglandrum closed 4 years ago

greglandrum commented 4 years ago

I've verified that the maeparser can read all of these in now and, manually, that a couple of the templates that previously had stereo still match molecules with and without stereo and everything looks fine.

ZontaNicola commented 4 years ago

that's great, thanks for doing this, Greg! merging the PR