bhmm / legacy-bhmm-force-spectroscopy-manuscript

Bayesian hidden Markov models for analysis of single-molecule trajectory data
GNU Lesser General Public License v3.0
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added BaseEstimator and mixing.GMM from scikit-learn and removed it as a dependency. #47

Closed marscher closed 4 years ago

franknoe commented 9 years ago

Ah no, this creates an additional dependency on pyemma which we want to avoid (that's the purpose of the msmtools package). We'd need to include our k-means code too in _external. But I'd be fine to just use the k-means initialization for now - it's not clear why k-means would help.

Moreover I'd reduce the sklearn GMM module to what is really used, which is only a small subset (we only need to execute fit and retrieve the result)