Technical – FAS Research Computing https://www.rc.fas.harvard.edu .HARVARD UNIVERSITY | FACULTY OF ARTS & SCIENCES Wed, 16 Oct 2019 16:49:57 +0000 en-US hourly 1 https://www.rc.fas.harvard.edu/wp-content/uploads/2015/02/small_twitter-200x200.png Technical – FAS Research Computing https://www.rc.fas.harvard.edu 32 32 59814611 A Cautionary Tale https://www.rc.fas.harvard.edu/blog/a-cautionary-tale/ Wed, 16 Oct 2019 16:36:32 +0000 https://www.rc.fas.harvard.edu/?p=22000 by Paul Edmon, October 16, 2019 First, in order to not bury the lede, if you are a chemist using or have used the "Willoughby-Hoye" python scripts please be advised that there is a bug which may impact your results.  It is advised that you re-verify your results with the updated patched version.  See these articles for more details: https://pubs.acs.org/doi/10.1021/acs.orglett.9b03216…

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