19 citations · 37 across the 3 of their papers we have counts for
3 papers
cond-mat.mtrl-sci2024
Roadmap on Data-Centric Materials Science
Stefan Bauer, Peter Benner, Tristan Bereau +58
Science is and always has been based on data, but the terms "data-centric" and the "4th paradigm of" materials research indicate a radical change in how information is retrieved, h…
physics.chem-ph2022★ 18 cited
Identifying sequential residue patterns in bitter and umami peptides
Arghya Dutta, Tristan Bereau, Thomas A. Vilgis
The primary structures of peptides, originating from food proteins, affect their taste. Connecting primary structure to taste, however, is difficult because the size of the peptide…
physics.chem-ph2016★ 19 cited
Concurrent parametrization against static and kinetic information leads to more robust coarse-grained force fields
Joseph F. Rudzinski, Tristan Bereau
The parametrization of coarse-grained (CG) simulation models for molecular systems often aims at reproducing static properties alone. The reduced molecular friction of the CG repre…