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First refactor of Rid-kit#1

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amcadmus merged 34 commits intodeepmodeling:masterfrom
yanze039:master
May 25, 2021
Merged

First refactor of Rid-kit#1
amcadmus merged 34 commits intodeepmodeling:masterfrom
yanze039:master

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This is the first pr of rid-kit, the python package is named by 'rid'.
please review the structure and README.md.

unittest will be submitted in the next pr.

@amcadmus amcadmus merged commit 3c22a03 into deepmodeling:master May 25, 2021
amcadmus added a commit that referenced this pull request Jun 7, 2021
First refactor of Rid-kit
amcadmus pushed a commit that referenced this pull request Jun 7, 2021
amcadmus pushed a commit that referenced this pull request Jun 7, 2021
yanze039 pushed a commit that referenced this pull request Nov 18, 2022
yanze039 pushed a commit that referenced this pull request May 12, 2023
Choose cluster center as representative conformation
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3 participants