Computational mathematics for model reduction and predictive modelling in molecular and complex systems  21 - 29 May 2019

Organisers

Markos Katsoulakis, University of Massachusetts Amherst

Benedikt Leimkuhler, University of Edinburgh

Petr Pelchac, University of Delaware

Anders Szepessy, KTH Royal Institute of Technology

The workshop will address computational and theoretical issues in stochastic modeling and model reduction in molecular and complex systems. In particular, the program will include topics ranging from quantum to mesoscale modelling, with focus on uncertainty quantification, machine learning and approximate inference method, methods using both quantum and classical models, semiclassical limits and their computational aspect. Furthermore, the interplay between mathematical analysis, modeling and statistical physics and trade-offs between statistical (data-driven) learning and physicochemical modelling will be part of the discussions. The workshop aims at bringing together mathematicians and domain scientists interested in applications such as systems with excited states, empirical potentials, kinetic Monte Carlo methods and accelerated simulation methods determined from molecular dynamics, data assimilation and inference for predictive modeling of complex molecular systems.

21 to 24 May 2019 - CIB premises

27 to 29 May 2019 - CECAM premises

Name University Dates of visit
Christian Blau SciLifeLab 20/05/2019 - 30/05/2019
Eric Cances Ecole des Ponts ParisTech 20/05/2019 - 29/05/2019
Enrico Carlon KU Leuven 20/05/2019 - 30/05/2019
Michele Ceriotti EPFL 21/05/2019 - 29/05/2019
Christoph Dellago Universität Wien 26/05/2019 - 30/05/2019
François Gygi University of California 20/05/2019 - 30/05/2019
Jiequn Han Princeton University 20/05/2019 - 25/05/2019
Vagelis Harmandaris University of Crete 20/05/2019 - 30/05/2019
Gerhard Hummer Max Planck Institute of Biophysics 27/05/2019 - 29/05/2019
Markos Katsoulakis University of Massachusetts Amherst 20/05/2019 - 01/06/2019
Efthimios Kaxiras Harvard University 20/05/2019 - 30/05/2019
Bettina Keller Freie Universität Berlin 20/05/2019 - 30/05/2019
James Kermode University of Warwick 26/05/2019 - 30/05/2019
Petros Koumoutsakos ETHZ 23/05/2019 - 25/05/2019
Phaedon-Stelios Koutsourelakis Technische Universität München 23/05/2019 - 30/05/2019
Benedikt Leimkuhler University of Edinburgh 20/05/2019 - 29/05/2019
Tony Lelièvre Ecole des Ponts ParisTech 20/05/2019 - 25/05/2019
Jianfeng Lu Duke University 20/05/2019 - 25/05/2019
Mitchell Luskin University of Minnesota 20/05/2019 - 30/05/2019
Laurent Michel Université de Nice Sophia-Antipolis 20/05/2019 - 25/05/2019
Christoph Ortner University of Warwick 20/05/2019 - 30/05/2019
Yannis Pantazis FORTH - IACM 20/05/2019 - 30/05/2019
Paul Patrone NIST 20/05/2019 - 30/05/2019
Grigoris Pavliotis Imperial College 20/05/2019 - 30/05/2019
Petr Pelchac University of Delaware 21/05/2019 - 29/05/2019
Markus Reiher ETHZ 20/05/2019 - 30/05/2019
Luc Rey-Bellet University of Massachusetts Amherst 20/05/2019 - 30/05/2019
Jutta Rogal Ruhr-Universität Bochum 20/05/2019 - 30/05/2019
Emanuel Rubensson Uppsala University 20/05/2019 - 30/05/2019
Matthias Sachs Duke University 20/05/2019 - 30/05/2019
Mattias Sandberg KTH Royal Institute of Technology 20/05/2019 - 30/05/2019
Gideon Simpson Drexel University 20/05/2019 - 25/05/2019
Michail Stamatakis University College London 27/05/2019 - 29/05/2019
Gabriel Stoltz Ecole des Ponts ParisTech 20/05/2019 - 29/05/2019
Krzystof Szalewicz University of Delaware 20/05/2019 - 30/05/2019
Anders Szepessy KTH Royal Institute of Technology 21/05/2019 - 29/05/2019
Brian Van Koten University of Massachusetts Amherst 20/05/2019 - 30/05/2019
Gilles Vilmart UNIGE 20/05/2019 - 30/05/2019
Total Guests : 38
Name University Dates of visit
Total Guests : 0