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Fix to the issue #338 and issue #335 #339

Merged
merged 2 commits into from
Apr 12, 2021
Merged

Fix to the issue #338 and issue #335 #339

merged 2 commits into from
Apr 12, 2021

Commits on Apr 5, 2021

  1. Fix to the issue #338 and issue #335 

    Increase the tolerance to 10 degree. If sum Angles +/- 10 was close to 360,
we keep the angles rigid for cyclic molecules.
    @msoroush
    msoroush committed Apr 5, 2021
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Commits on Apr 12, 2021

  1. Implement general method to check distance for intra-nonbonded energi… 

    …es (elec and VdW) to avoid mistake in future implementations. All distance is now will be checked in force field class level.
    @msoroush
    msoroush committed Apr 12, 2021
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    a90923d View commit details
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