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20102018
most citedAll-atom simulations reveal how single point mutations promote serpin misfolding

32 citations · 71 across the 11 of their papers we have counts for

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cond-mat.soft2014

Variational Scheme to Compute Protein Reaction Pathways using Atomistic Force Fields with Explicit Solvent

S. a Beccara, L. Fant, P. Faccioli

We introduce a variational approximation to the microscopic dynamics of rare conformational transitions of macromolecules. Within this framework it is possible to simulate on a sma…