MetaSimulation of Nonequilibrium Processes

The MSNEP Group


Jerome Delhommelle, PhD

Habilitation in Theoretical Chemistry, Université Henri Poincare, Nancy I
Ph.D. in Molecular Physics & Chemistry, Université Paris-Saclay
Ecole Normale Superieure, Paris-Saclay

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Tharuka Artigalage Don

BSc (Hons) in Bioinformatics, University of Colombo (Sri Lanka)

ML-guided design of biomimetic materials

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Noshaba Noshia

MPhil in Chemistry, University of Lahore (Pakistan)
MSc in Chemistry, University of Agriculture Faisalabad (Pakistan)

Computational & ML analysis of phase transitions


Kithma Sajini

BSc (Hons) in Computational Chemistry, University of Colombo (Sri Lanka)

Computational design of nanoclusters and nanomaterials



Angelina Blahodatna

Computational and ML analysis of chemical dynamics

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Emma Goyette

Self-Organization in Active Matter


Thomas O'Connor

Machine Learning collective behavior in complex systems

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Arthea Valderrama

ML-guided protein design