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Fix bug with adding positional restraints for OpenMM (ParmEd#1301)#1302

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swails merged 1 commit into
ParmEd:masterfrom
nffaruk:master
Apr 1, 2023
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Fix bug with adding positional restraints for OpenMM (ParmEd#1301)#1302
swails merged 1 commit into
ParmEd:masterfrom
nffaruk:master

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@nffaruk

@nffaruk nffaruk commented Apr 1, 2023

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Closes #1301 by calling the coordinate array from the Rst7 object.

@swails

swails commented Apr 1, 2023

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Thanks!

@swails swails merged commit 3f68799 into ParmEd:master Apr 1, 2023
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Error when using restraints with OpenMM within ParmEd

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