Andreas Vitalis

Publication Activity (10 Years)

Years Active: 2017-2023
Publications (10 Years): 7

Top Topics

Cognitive Decline

Depressive Symptoms

Molecular Dynamics Simulations

Top Venues

The Journal of chemical physics

Journal of chemical theory and computation

The Journal of biological chemistry

Journal of chemical information and modeling

This page only lists publications with an associated author ORCID identifier.

Publications

Julian Widmer, Cassiano Langini, Andreas Vitalis, Amedeo Caflisch
Optimized reaction coordinates for analysis of enhanced sampling. The Journal of chemical physics 159 (1) (2023)
Jean-Rémy Marchand, Tim Knehans, Amedeo Caflisch, Andreas Vitalis
An ABSINTH-Based Protocol for Predicting Binding Affinities between Proteins and Small Molecules. Journal of chemical information and modeling 60 (10) (2020)
Francesco Cocina, Andreas Vitalis, Amedeo Caflisch
Sapphire-Based Clustering. Journal of chemical theory and computation 16 (10) (2020)
Marco Bacci, Amedeo Caflisch, Andreas Vitalis
On the removal of initial state bias from simulation data. The Journal of chemical physics 150 (10) (2019)
Marco Bacci, Cassiano Langini, Jiří Vymětal, Amedeo Caflisch, Andreas Vitalis
Focused conformational sampling in proteins. The Journal of chemical physics 147 (19) (2018)
Marco Bacci, Jiří Vymětal, Maja Mihajlovic, Amedeo Caflisch, Andreas Vitalis
Amyloid β Fibril Elongation by Monomers Involves Disorder at the Tip. Journal of chemical theory and computation 13 (10) (2017)
Cassiano Langini, Amedeo Caflisch, Andreas Vitalis
The ATAD2 bromodomain binds different acetylation marks on the histone H4 in similar fuzzy complexes. The Journal of biological chemistry 292 (40) (2017)