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Bayesian Energy Landscape Tilting: Towards Concordant Models of Molecular Ensembles

bioRxiv

Jan 24, 2014

Kyle A. BeauchampRhiju Das

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Abstract

Predicting biological structure has remained challenging for systems such as dis- ordered proteins that take on myriad conformations. Hybrid simulation/experiment strategies have been undermined by difficulties in evaluating errors from computa- tional model inaccuracies and data uncert...read more

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Landscapes
Chemicals
Simulation
Proline
Accu
Structure
Alanine
Alanyl-alanyl-alanine
Molecular Target
Molecular Film
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Bayesian Energy Landscape Tilting: Towards Concordant Models of Molecular Ensembles

bioRxiv

Jan 24, 2014

Kyle A. BeauchampRhiju Das

DOI: 10.1101/002048

Abstract

Predicting biological structure has remained challenging for systems such as dis- ordered proteins that take on myriad conformations. Hybrid simulation/experiment strategies have been undermined by difficulties in evaluating errors from computa- tional model inaccuracies and data uncert...read more

Mentioned in this Paper

Landscapes
Chemicals
Simulation
Proline
Accu

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