Exmol

Latest version: v3.2.2

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3.2.2

What's Changed
* Adding kernel regex arg to fix kernel usage by all nbs by Jgmedina95 in https://github.com/ur-whitelab/exmol/pull/153
* Fix docs by Jgmedina95 in https://github.com/ur-whitelab/exmol/pull/154
* Adjusted names on some of the functional groups by whitead in https://github.com/ur-whitelab/exmol/pull/156

New Contributors
* Jgmedina95 made their first contribution in https://github.com/ur-whitelab/exmol/pull/153

**Full Changelog**: https://github.com/ur-whitelab/exmol/compare/v3.2.1...v3.2.2

3.2.1

What's Changed
* Added flag for returning more functional groups by whitead in https://github.com/ur-whitelab/exmol/pull/151


**Full Changelog**: https://github.com/ur-whitelab/exmol/compare/v3.2.0...v3.2.1

3.2.0

What's Changed
* papers fix by qcampbel in https://github.com/ur-whitelab/exmol/pull/148
* Added functional group nomenclature method by whitead in https://github.com/ur-whitelab/exmol/pull/149

New Contributors
* qcampbel made their first contribution in https://github.com/ur-whitelab/exmol/pull/148

**Full Changelog**: https://github.com/ur-whitelab/exmol/compare/v3.1.0...v3.2.0

3.1.0

What's Changed
* Added check to keep consistency with alphabet by whitead in https://github.com/ur-whitelab/exmol/pull/143
* Issue 144 - remove langchain by geemi725 in https://github.com/ur-whitelab/exmol/pull/145


**Full Changelog**: https://github.com/ur-whitelab/exmol/compare/v3.0.3...v3.1.0

3.0.3

What's Changed
* Issue-137, import exmol not working with python 3.11 by geemi725 in https://github.com/ur-whitelab/exmol/pull/138


**Full Changelog**: https://github.com/ur-whitelab/exmol/compare/v3.0.2...v3.0.3

3.0.2

* Now try to find largest component with multiple compounds separated via . in SMILES
* Added langchain for text explanations

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