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v0.0.9.0

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@andthum andthum released this 31 Oct 15:25
v0.0.9.0
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andthum Andreas Thum
GPG key ID: D2A6D0FBA984CE20
Learn about vigilant mode.
d95fbbe
This commit was created on GitHub.com and signed with GitHub’s verified signature.
GPG key ID: B5690EEEBB952194
Learn about vigilant mode.

What's Changed

New features

  • New script scripts/structure/densmap.py that computes 2-dimensional number density maps by @andthum in #205
  • New function mdtools.dtrj.transition that calculates transition rates averaged over all compounds and over all states by @andthum in #211
  • mdtools/misc/dtrj_lifetimes/compare_dtrj_lifetime_methods.py and mdtools/misc/dtrj_lifetimes/plt_lifetimes.py: Additionally, calculate and plot the coefficient of variation of the underlying lifetime distribution by @andthum in #225

Bug fixes

  • mdtools/misc/dtrj_lifetimes/compare_dtrj_lifetime_methods.py: Fix fits of the Kaplan-Meier estimated survival function by @andthum in #225

Full Changelog: v0.0.8.0...v0.0.9.0

Contributors

andthum
Assets 2
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