The Center for Molecular Modeling focuses on frontier research in six major areas - chemical kinetics in nanoporous materials, computational material research on the nanoscale, spectroscopy, many-particle physics, model development & bio- and organic chemistry. Our multidisciplinary research team is currently composed of about 40 researchers from the Faculties of Sciences (WE05) and Engineering and Architecture (EA17, EA08) of Ghent University.

Welcome to the Center for Molecular Modeling

New A1-publications

J. Wieme, K. Lejaeghere, G. Kresse, V. Van Speybroeck, Nature Communications, 9, 4899, 2018
R. Demuynck, J. Wieme, S.M.J. Rogge, K. Dedecker, L. Vanduyfhuys, M. Waroquier, V. Van Speybroeck, Journal of Chemical Theory and Computation, 14 (11), pp 5511–5526, 2018
M. Riquelme, A. Lara, D.L. Mobley, T. Verstraelen, A.R. Matamala, E. Vohringer-Martinez, Journal of Chemical Information and Modeling (JCIM), 58 (9), 1779-1797, 2018

News

Porous materials measure temperature at molecular level
Researchers of the Center for Molecular Modeling (Ghent University) investigated how so-called metal-organic frameworks breathe as it gets hotter or colder. Using advanced computer simulations, they found that the temperature at which these... more
Sven Rogge gaat door naar de finale van de Vlaamse PhD Cup
Op woensdag 31 oktober hebben Annelies Coene (EA08), Lode Daelemans (EA11) en Sven Rogge (CMM, EA17) het beste van zichzelf gegeven in de halve finale van de Vlaamse PhD Cup. 16 kandidaten hebben die avond hun jarenlange doctoraatsonderzoek... more