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0.19.1 Trailblaze fix and restart stability from OpenMMTools
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@Lnaden Lnaden released this 28 Nov 01:36
· 820 commits to master since this release
0.19.1
1fc69f6
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Learn about vigilant mode.
  • OpenMMTools 0.13.4 now required to fix issues listed below
  • Restrained atoms to absolute coordinates caused issue in Trailblaze with a Barostat
  • Last restart attempt uses a slower, but more robust restart method
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