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Version 1.0.5
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@davidlmobley davidlmobley released this 06 Apr 04:15
· 102 commits to master since this release
v1.0.5
13c6453

Version 1.0.5 adds an extensive set of new parameters (and modification of existing SMIRKS to improve coverage) to provide full coverage of our small filtered set from DrugBank, which we internally call MiniDrugBank. A full set of changes is detailed in openforcefield/smarty#232.

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