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use and document conda packages #216

Merged
merged 2 commits into from
Sep 9, 2021
Merged

use and document conda packages #216

merged 2 commits into from
Sep 9, 2021

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orbeckst
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@orbeckst orbeckst commented Sep 9, 2021 •
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@orbeckst
include conda installation in docs
e02c848 
- fix #215
- updated installation instructions
- updated Gromacs -> GROMACS, minor doc fixes
- update CHANGES
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codecov bot commented Sep 9, 2021 •
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Codecov Report

Merging #216 (14d5892) into master (d570df4) will not change coverage.
The diff coverage is n/a.

Impacted file tree graph

@@           Coverage Diff           @@
##           master     #216   +/-   ##
=======================================
  Coverage   66.46%   66.46%           
=======================================
  Files          23       23           
  Lines        4324     4324           
  Branches      682      682           
=======================================
  Hits         2874     2874           
  Misses       1258     1258           
  Partials      192      192
Impacted Files Coverage Δ
gromacs/__init__.py 72.72% <ø> (ø)

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@orbeckst orbeckst linked an issue Sep 9, 2021 that may be closed by this pull request
codecov failure "'Too many uploads to this commit.'" #209
Closed
@orbeckst orbeckst changed the title include conda installation in docs use and document conda packages Sep 9, 2021
@orbeckst
updated CI workflow
14d5892 
- close #209
- run cron CI only once a week
- use numkit bioconda package
- use matplotlib-base instead of matplotlib to avoid pulling qt
@orbeckst orbeckst merged commit 8a6e5b2 into master Sep 9, 2021
@orbeckst orbeckst deleted the update-docs-conda branch September 9, 2021 21:11
jandom added a commit to jandom/GromacsWrapper that referenced this pull request Nov 5, 2023
@jandom
fix Becksteinlab#216: angle parameters are not being read from topolo…
607f448 
…gy file
orbeckst pushed a commit that referenced this pull request Nov 9, 2023
@jandom
fix #216: angle parameters are not being read from topology file (#264)
691393c 
* fix #216: angle parameters are not being read from topology file
* refactored heavily to support all angle types
* add tests (with pytest.MonkeyPatch)
* update CHANGES
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update installation instructions for conda codecov failure "'Too many uploads to this commit.'"
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@orbeckst