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Update discussion of atom mapping from original best practices #8

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fjclark opened this issue Dec 13, 2024 · 0 comments
Open

Update discussion of atom mapping from original best practices #8

fjclark opened this issue Dec 13, 2024 · 0 comments
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@fjclark
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fjclark commented Dec 13, 2024

Proposed Change

Update the atom mapping discussion moved here from the first paper (alchemistry/alchemical-best-practices#145).

Proposed Authors and Reviewers

Please volunteer (before the end of January) to author/ review and state when you're available. Authors, please say roughly when you plan to contribute the changes (no later than the end of May).

Proposed author: @RiesBen?
Proposed reviewer: Volunteer wanted

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