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0.22.2 - Topography Property Copy

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@Lnaden Lnaden released this 30 May 20:30
0.22.2
377c09d
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Learn about vigilant mode.
  • Critical bug fix for Topology where ions of charged ligands were considered part of the ligand with respect to restraints.
  • Online analysis MBAR failures can no longer halt simulations
  • Added ability for analyze CLI (--fulltraj) and API (use_full_trajectory=True) to force use the full trajectory
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