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Release 0.1.0.a1

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@dotsdl dotsdl released this 20 Feb 03:45
· 357 commits to master since this release
0.1.0.a1
ccb9327

First alpha release. Features:

  1. Parsers for GROMACS, including reduced potentials and gradients.
  2. Subsampler functions for slicing, statitistical inefficiency, equilibration detection.
  3. Minimally functional estimators for MBAR, TI.
Assets 2
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