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Releases: martinp23/bindmc

v0.1.11

23 Jun 10:34
c13aef5

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  • Add fast_exchange helper chips for all species associated with a given component
  • Add min/max values to parameters in deafult models
  • Remove the default term for fast exchange, which was annoying
  • Auto-enable fast-exchange cards/terms when the user clicks a chip
  • Clarify and dependencies, remove those that are covered by bindtools and not required here
  • Remove python 3.14 support until next numba release (or beyond)
  • Remove arviz dependency

v0.1.9

22 Jun 09:07
eb9e018

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  • Fix a plotting bug for fit results so that the plots are now correct
  • Improve handling of exptdata and rawdata
  • Fix bug associated with chips on data_model tab where they sometimes stopped working

v0.1.8

20 Jun 09:05
fee5e0a

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What's Changed

Full Changelog: v0.1.7...v0.1.8

v0.1.7

19 Jun 13:01
32eb1bf

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What's Changed

  • Fixes for analytical NMR complex handling: back to user-defined, no automatic detection by @martinp23 in #4
  • fitting table now shows scientific notation for chisqr (=SSR)
  • add Nelder-Mead, l-bfgs-b

Full Changelog: v0.1.6...v0.1.7

v0.1.6

19 Jun 04:08
db3743f

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What's Changed

Full Changelog: v0.1.5...v0.1.6

v0.1.5

17 Jun 22:58
9863f90

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fix terrible launch failures

v0.1.4

17 Jun 10:49
cb8cd7d

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  • Bugfix for simple models with known concentratiosn (E.g. NMR slow exchange)
  • Fix test suite
  • Automate tests

v0.1.3

15 Jun 04:43

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  • Various linting
  • Fix issue with saving files in native mode
  • Allow program to run as module (python -m bindmc)
  • update docs
  • fix tests

Initial release v0.1.1-alpha1

14 Jun 11:25

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Initial release of BindMC application for testing.