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Author: Vincent Voelz

Better folding through biased simulations

November 16, 2024 by Vincent Voelz

A central goal of Folding@home is to use distributed computing to solve problems that would otherwise be intractable.   Protein folding is a terrific problem to address with this approach:…

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Predicting drugs’ lipophilicity with Folding@home

October 3, 2024 by Vincent Voelz

Computational chemistry and machine learning continue to play an increasing role in drug discovery.   One advance has been the increased accuracy with which we can predict the affinity of…

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