
with the expertise in the field of modelling of molecules, materials, and biological processes.

for applications in societal relevant areas such as health, energy and sustainability.





from oil paint layers to industrially produced compounds, covering polymerization and
long-term degradation.



rigidity is mediated by specific binding and hydrogen-bond breakage.

In particular, the research focuses on
News
2 PhD vacancies Computational Chemistry and AI
In collaboration with Microsoft Research Amsterdam we are actively looking for a PhD candidates for projects on the crossroads between Computational Chemistry and AI. Full posting on
Vacancy for a postdoc in biomolecular simulation
Do you enjoy working in an interdisciplinary research setting? Do you like studying problems in molecular biology using chemical knowledge, algorithms and high performance computing?
Andrew Ferguson visiting professor at Amsterdam Centre for Multiscale Modelling
Andrew Ferguson, Associate Professor at the Fritzker School of Molecular Engineering of the University of Chicago, has been appointed visiting professor in Computational Science at
Cum Laude for chemistry PhD graduate Alberto Pérez de Alba Ortíz
On 22 September, Alberto Pérez de Alba Ortíz successfully defended his PhD thesis entitled ‘Traversing the free-energy pathways of intricate biomolecular processes – enhanced simulation
Jocelyne Vreede is new programme director of BSc in Chemical Sciences
Growing appreciation and interest in UvA/VU joint degree 1 February 2022 Since the beginning of this year, Dr Jocelyne Vreede is the new programme director


Structure prediction of a bacterial spore membrane protein
Dr Jocelyne Vreede of the research group Computational Chemistry at the Van ‘t Hoff Institute for Molecular Sciences (HIMS) worked together with researchers at the