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cabb99
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open3spn2
An implementation of the 3SPN2 and 3SPN2.C coarse-grained DNA forcefields in OpenMM
MIT License
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Updates to 0.3.2
#17
Closed
cabb99
closed
1 year ago
cabb99
commented
1 year ago
Updates code to OpenMM 8.0
Optimizes non-bonded exclusion setup
Removes X3DNA dependency
Moves CI from travis to github actions
Converts parameter to KJ/mol (openMM and literature default)