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list features to be moved from alchemical-analysis to alchemlyb #54

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orbeckst opened this issue Jan 16, 2018 · 4 comments
Open

list features to be moved from alchemical-analysis to alchemlyb #54

orbeckst opened this issue Jan 16, 2018 · 4 comments
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@orbeckst
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We would like to produce a list of highly desirable alchemical-analysis features in alchemlyb.

As expressed in the Roadmap, the idea is to use little pieces from alchemical-analysis and re-implement in alchemlyb together with tests and docs.

@alchemistry/alchemlyb : Please add what you want to see (or what you want to contribute) to the wiki page alchemical analysis features.

Once we have a list of features that we agree to be important then it becomes a bit easier to spend resources on working on them.

@orbeckst
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@mrshirts many thanks for your edits!

@davidlmobley
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Noted, will try to get to this before the weekend.

@davidlmobley
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Added my comments. I think this pretty much covers it; @brycestx and @shuail , anything else from your end?

@shuail
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shuail commented Jan 19, 2018

Looks good to me. Thanks for drafting this up!

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