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Add ability to calculate RDF to a specified point #973

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merged 6 commits into from
Jun 17, 2022

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@drroe drroe commented Jun 17, 2022

Version 6.8.1.

Adds toxyz <x>,<y>,<z> keyword to radial action to allow RDF calculation to point specified by <x> <y> <z>. Also adds test and updates manual.

@drroe drroe self-assigned this Jun 17, 2022
@drroe drroe merged commit 5a2d6b2 into Amber-MD:master Jun 17, 2022
@drroe drroe deleted the radial.specified.xyz branch June 17, 2022 16:40
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