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0.13.3 - Critical Bugfix to SamplerState Context Manipulation

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@Lnaden Lnaden released this 21 Nov 12:56
72cba4d

Critical Fixes

  • SamplerState.apply_to_context() applies box vectors before positions are set to prevent a bug on non-Reference OpenMM Platforms which can re-order system atoms and sample the wrong distribution. (#305)

Additional Fixes

  • LibYAML is now optional (#304)
  • Fix AppVeyor testing against Python 3.4 (now Python 3.5/3.6 and NumPy 1.12) (#307)
  • Release History now included in online Docs