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v2022.3.0

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@gbouvignies gbouvignies released this 22 Feb 22:19
· 141 commits to main since this release

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

Full Changelog: v2022.2.0...v2022.3.0