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Merge pull request #123 from hjkgrp/updateRTD Tests #90: Commit fdd4437 pushed by mane292
1m 55s main
main
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Added new pdb only mode where pdb files with a charge encoded in the … Tests #89: Pull request #123 opened by mane292
1m 47s updateRTD
updateRTD
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Merge pull request #122 from hjkgrp/updateRTD Tests #88: Commit e8db5f9 pushed by mane292
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main
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updated readthedocs Tests #87: Pull request #122 opened by mane292
2m 5s updateRTD
updateRTD
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Merge pull request #121 from hjkgrp/newreadthedocs Tests #86: Commit 10764ef pushed by mane292
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main
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fixed string error with pyef version Tests #85: Pull request #121 opened by mane292
2m 1s newreadthedocs
newreadthedocs
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Merge pull request #120 from hjkgrp/fixrtd Tests #84: Commit 179a7a5 pushed by mane292
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main
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Fix shell quoting in RTD verification command Tests #83: Pull request #120 synchronize by mane292
2m 15s fixrtd
fixrtd
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Merge pull request #119 from hjkgrp/fixrtd Tests #82: Commit efda9f8 pushed by mane292
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main
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Fix missing channels in docs/requirements.yaml Tests #81: Pull request #119 opened by mane292
2m 33s fixrtd
fixrtd
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Merge pull request #118 from hjkgrp/readthedocsupate Tests #80: Commit 2a8f812 pushed by mane292
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main
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Fixed build readthedocs Tests #79: Pull request #118 opened by mane292
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readthedocsupate
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Merge pull request #117 from hjkgrp/fixDocumentation Tests #78: Commit b604842 pushed by mane292
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updated readthedocs Tests #77: Pull request #117 opened by mane292
2m 9s fixDocumentation
fixDocumentation
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Fix typos and update structure paths in README Tests #76: Commit 05973d9 pushed by mane292
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Update README.md Tests #75: Commit ca2248d pushed by mane292
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Merge pull request #116 from hjkgrp/defautlkwargs Tests #74: Commit b3fefba pushed by mane292
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main
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Added defauly kwargs for key functionality Tests #73: Pull request #116 opened by mane292
15m 3s defautlkwargs
defautlkwargs
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Update README.md Tests #72: Commit 5303404 pushed by mane292
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Merge pull request #115 from hjkgrp/fixsettings Tests #71: Commit 42e1b9f pushed by mane292
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main
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fixed partial charge schemes, added defaults for ESP Tests #70: Pull request #115 opened by mane292
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fixsettings
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Merge pull request #114 from hjkgrp/testcharges Tests #69: Commit f58f4f2 pushed by mane292
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main
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Testcharges Tests #68: Pull request #114 opened by mane292
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testcharges
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Merge pull request #113 from hjkgrp/testcharges Tests #67: Commit 9a4284b pushed by mane292
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main
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Fixed readme and documentation, added a new getCharges() function and… Tests #66: Pull request #113 opened by mane292
2m 14s testcharges
testcharges
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