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@drroe drroe commented Aug 24, 2020

Some iterator math in an inner loop of the IRED analysis seems to have confused PGI compilers. This PR slightly refactors the iterator usage to eliminate the issue.

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swails commented Aug 24, 2020

Well the Jenkins build passed without posting a message about the PGI compilers, so it looks like that did the trick!

@drroe drroe merged commit e9f72ee into Amber-MD:master Aug 24, 2020
@drroe drroe deleted the fixiredpgi branch August 24, 2020 15:12
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