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This repository has been archived by the owner on Sep 11, 2023. It is now read-only.

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@marscher marscher released this 10 Apr 12:41
· 1047 commits to devel since this release

New features:

  • coordinates: added Nystroem-TICA, which uses sparse sampling to approximate the input space. #1261, #1273
  • plots: added multi-dimensional stacked histogram plot function. #1264

Fixes:

  • msm: Chapman Kolmogorov validator ensures there are no side effects on the tested model. #1255
  • datasets: Fix default values for kT to ensure integrator produces sane values. #1272, #1275
  • coordinates: fixed handling of default chunksize. #1284