The BICePs algorithm (Bayesian Inference of Conformational Populations) is a statistically rigorous Bayesian inference method to reconcile theoretical predictions of conformational state populations with sparse and/or noisy experimental measurements and objectively compare different models. Supported experimental observables include:
NMR chemical shifts (HA
,NH
, CA
and N
).
J couplings (both small molecules and amino acids) (J
).
Hydrogen--deuterium exchange (HDX
).
We recommend that you install biceps
via pip
:
$ pip install BICePs