Edina Rosta

6PUBLICATIONS
9CO-AUTHORS
Theoretical quantum chemistryComputational methods in fluid flow, heat and mass transfer (incl. computational fluid dynamics)Integrable systems (classical and quantum)Statistical mechanics, physical combinatorics and mathematical aspects of condensed matterStochastic analysis and modelling
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Publications (6)

|Jan 15, 2021
A simplified charge projection scheme for long-range electrostatics in ab initio QM/MM calculations.

Xiaoliang Pan, Kwangho Nam, Evgeny Epifanovsky

|Dec 09, 2020
Simulated tempering with irreversible Gibbs sampling techniques.

Fahim Faizi, Pedro J Buigues, George Deligiannidis

|Mar 16, 2020
Correlation functions, mean first passage times, and the Kemeny constant.

Adam Kells, Vladimir Koskin, Edina Rosta

|Nov 24, 2019
Markov Models of Molecular Kinetics.

Frank Noé, Edina Rosta

|Apr 08, 2019
Mean first passage times in variational coarse graining using Markov state models.

Adam Kells, Zsuzsanna É Mihálka, Alessia Annibale

|Aug 24, 2018
Limiting relaxation times from Markov state models.

Adam Kells, Alessia Annibale, Edina Rosta

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Frequent Collaborators

3 joint publications

Adam Kells

3 joint publications

Alessia Annibale

1 joint publications

Frank Noé

1 joint publications

Fahim Faizi