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CVPack v0.7.0

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@craabreu craabreu released this 21 Jan 22:07
· 63 commits to main since this release

What's Changed

  • Allows AttractionStrength extract reference value from a context by @craabreu in #45
  • Reduces testing time of sheet rmsd content CV by @craabreu in #46
  • Adds method to set unused force group by @craabreu in #47
  • Improves AtomicFunction and CentroidFunction CV (breaks API) by @craabreu in #48
  • Improves performance of unit tests by @craabreu in #49
  • Fixes NumberOfContacts CV (breaks API) by @craabreu in #50
  • Allows reference value redefinition for normalizing residue coordination by @craabreu in #51
  • Enhances effective mass calculation by ignoring null forces by @craabreu in #52

Full Changelog: v0.6.1...v0.7.0