Chemex

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2022.3.5

What's Changed
* [Fix the 3st_eyring model](https://github.com/gbouvignies/ChemEx/commit/04c9ad1e1b14c3b0384a3cfef45ffec88d42a070)
* Bump numpy from 1.24.2 to 1.24.3 by dependabot in https://github.com/gbouvignies/ChemEx/pull/131
* Bump eslint from 8.38.0 to 8.39.0 in /website by dependabot in https://github.com/gbouvignies/ChemEx/pull/132


**Full Changelog**: https://github.com/gbouvignies/ChemEx/compare/v2022.3.4...v2022.3.5

2022.3.4

**Full Changelog**: https://github.com/gbouvignies/ChemEx/compare/v2022.3.3...v2022.3.4

* [Fix a bug when correcting the spin system name](https://github.com/gbouvignies/ChemEx/commit/c3c75ed277004508cab6a00a3deb8babadfd2276)
* [Update the doc of the 1HN CPMG experiments](https://github.com/gbouvignies/ChemEx/commit/7a8774e8352b7abed1bd548762a56c7c2b282ab3)

2022.3.3

**Full Changelog**: https://github.com/gbouvignies/ChemEx/compare/v2022.3.2...v2022.3.3

* [Bump docusaurus and rapidfuzz version](https://github.com/gbouvignies/ChemEx/commit/9a60128d67981d42a66da5943c4254cfb0441edd)

2022.3.2

**Full Changelog**: https://github.com/gbouvignies/ChemEx/compare/v2022.3.1...v2022.3.2

* [Add pre- and post-equilibration delays in 1H CPMG](https://github.com/gbouvignies/ChemEx/commit/1b84a334f1c983ab7845a8b062406ccb4bc649f6)
* [Fix a bug when all parameters were fixed in simul](https://github.com/gbouvignies/ChemEx/commit/cb8383fac698fc730493659b70b4bd3d402100bc)
* [Correct a bug in the correction of profile names](https://github.com/gbouvignies/ChemEx/commit/9ed2ced566c0c2ae9013b295d7c51ce06549f31d)

2022.3.1

What's Changed
* [Fix parameter estimations using MF parameter](https://github.com/gbouvignies/ChemEx/commit/89369c2a0ae684c26c02fe0dfaf0fc8835c1c818)
* [Fix a bug in cpmg_1hn_ap_0013](https://github.com/gbouvignies/ChemEx/commit/eaaa33d2b0903c5e2b52ea689868ea6516b52c92)
* Bump markdown-it-py from 2.1.0 to 2.2.0 by dependabot in https://github.com/gbouvignies/ChemEx/pull/105
* Bump eslint from 8.34.0 to 8.35.0 in /website by dependabot in https://github.com/gbouvignies/ChemEx/pull/106
* Bump pre-commit from 2.21.0 to 3.1.1 by dependabot in https://github.com/gbouvignies/ChemEx/pull/107
* Bump rich from 13.3.1 to 13.3.2 by dependabot in https://github.com/gbouvignies/ChemEx/pull/108
* Bump matplotlib from 3.7.0 to 3.7.1 by dependabot in https://github.com/gbouvignies/ChemEx/pull/109
* Bump types-cachetools from 4.2.10 to 5.3.0.4 by dependabot in https://github.com/gbouvignies/ChemEx/pull/110
* Bump pydantic from 1.10.5 to 1.10.6 by dependabot in https://github.com/gbouvignies/ChemEx/pull/111
* Bump eslint from 8.35.0 to 8.36.0 in /website by dependabot in https://github.com/gbouvignies/ChemEx/pull/112
* Bump webpack from 5.73.0 to 5.76.1 in /website by dependabot in https://github.com/gbouvignies/ChemEx/pull/113
* Bump pre-commit from 3.1.1 to 3.2.0 by dependabot in https://github.com/gbouvignies/ChemEx/pull/114
* Bump types-cachetools from 5.3.0.4 to 5.3.0.5 by dependabot in https://github.com/gbouvignies/ChemEx/pull/115
* Bump rich from 13.3.2 to 13.3.3 by dependabot in https://github.com/gbouvignies/ChemEx/pull/116
* Bump docusaurus/preset-classic from 2.3.1 to 2.4.0 in /website by dependabot in https://github.com/gbouvignies/ChemEx/pull/117
* Bump pre-commit from 3.2.0 to 3.2.1 by dependabot in https://github.com/gbouvignies/ChemEx/pull/118
* Bump docusaurus/eslint-plugin from 2.3.1 to 2.4.0 in /website by dependabot in https://github.com/gbouvignies/ChemEx/pull/119
* Bump pydantic from 1.10.6 to 1.10.7 by dependabot in https://github.com/gbouvignies/ChemEx/pull/120
* Bump pre-commit from 3.2.1 to 3.2.2 by dependabot in https://github.com/gbouvignies/ChemEx/pull/121
* Bump rapidfuzz from 2.13.7 to 2.15.0 by dependabot in https://github.com/gbouvignies/ChemEx/pull/122
* Bump eslint from 8.36.0 to 8.37.0 in /website by dependabot in https://github.com/gbouvignies/ChemEx/pull/123
* Bump lmfit from 1.1.0 to 1.2.0 by dependabot in https://github.com/gbouvignies/ChemEx/pull/124
* Bump eslint from 8.37.0 to 8.38.0 in /website by dependabot in https://github.com/gbouvignies/ChemEx/pull/125


**Full Changelog**: https://github.com/gbouvignies/ChemEx/compare/v2022.3.0...v2022.3.1

2022.3.0

What's Changed
Add two kinetic models for binding reactions
This commits adds new kinetic models for two binding mechanisms.
- '3st_induced_fit' models a binding event followed by a change of
conformation. The binding event parameters are a dissociation
constant "KD_AB" and an off-rate "KOFF_AB". The change of
conformation is modeled using two kinetic rate constants: "KBC" and
"KCB".
- '3st_double_binding" models a fork model where a protein can bind
its partner in two different ways. The parameters of the binding
event AB (AC) are a dissociation constant "KD_AB" ("KD_AC") and an
off-rate "KOFF_AB" ("KOFF_AC").

The two models require two parameters, "p_total" and "l_total", to be
specified in the conditions.
Add a 15N SQ shift experiment

* Bump loader-utils from 2.0.2 to 2.0.4 in /website by dependabot in https://github.com/gbouvignies/ChemEx/pull/77
* Bump json5 from 2.2.1 to 2.2.3 in /website by dependabot in https://github.com/gbouvignies/ChemEx/pull/79
* Bump minimatch, recursive-readdir and serve-handler in /website by dependabot in https://github.com/gbouvignies/ChemEx/pull/80
* Bump ua-parser-js from 0.7.31 to 0.7.33 in /website by dependabot in https://github.com/gbouvignies/ChemEx/pull/82
* Bump http-cache-semantics from 4.1.0 to 4.1.1 in /website by dependabot in https://github.com/gbouvignies/ChemEx/pull/83
* Bump sideway/formula from 3.0.0 to 3.0.1 in /website by dependabot in https://github.com/gbouvignies/ChemEx/pull/84
* Bump eta, docusaurus/core and docusaurus/preset-classic in /website by dependabot in https://github.com/gbouvignies/ChemEx/pull/85
* Bump future from 0.18.2 to 0.18.3 by dependabot in https://github.com/gbouvignies/ChemEx/pull/86
* Bump actions/checkout from 2 to 3 by dependabot in https://github.com/gbouvignies/ChemEx/pull/87
* Bump actions/setup-python from 3 to 4 by dependabot in https://github.com/gbouvignies/ChemEx/pull/88
* Bump eslint from 8.23.1 to 8.33.0 in /website by dependabot in https://github.com/gbouvignies/ChemEx/pull/90
* Bump hast-util-is-element from 1.1.0 to 2.1.3 in /website by dependabot in https://github.com/gbouvignies/ChemEx/pull/91
* Bump numpy from 1.24.1 to 1.24.2 by dependabot in https://github.com/gbouvignies/ChemEx/pull/94
* Bump eslint-plugin-react from 7.31.8 to 7.32.2 in /website by dependabot in https://github.com/gbouvignies/ChemEx/pull/92
* Bump docusaurus/eslint-plugin from 2.1.0 to 2.3.1 in /website by dependabot in https://github.com/gbouvignies/ChemEx/pull/93
* Bump cachetools from 5.2.0 to 5.3.0 by dependabot in https://github.com/gbouvignies/ChemEx/pull/95
* Bump matplotlib from 3.6.2 to 3.6.3 by dependabot in https://github.com/gbouvignies/ChemEx/pull/96
* Bump rich from 13.0.0 to 13.3.1 by dependabot in https://github.com/gbouvignies/ChemEx/pull/97
* Bump matplotlib from 3.6.3 to 3.7.0 by dependabot in https://github.com/gbouvignies/ChemEx/pull/98
* Bump pydantic from 1.10.4 to 1.10.5 by dependabot in https://github.com/gbouvignies/ChemEx/pull/101
* Bump scipy from 1.10.0 to 1.10.1 by dependabot in https://github.com/gbouvignies/ChemEx/pull/102
* Bump eslint from 8.33.0 to 8.34.0 in /website by dependabot in https://github.com/gbouvignies/ChemEx/pull/103


**Full Changelog**: https://github.com/gbouvignies/ChemEx/compare/v2022.2.0...v2022.3.0

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