Computational Chemistry
Van 't Hoff Institute for Molecular Sciences University of Amsterdam
Members
Dr. T. (Tristan) Bereau
Prof. dr. P.G. (Peter) Bolhuis
Dr. D. (David) Dubbeldam
Dr. ir. B. (Bernd) Ensing
Prof. dr. (Pieter) Iedema
Prof. dr. E.J. (Evert Jan) Meijer
Dr. J. (Jocelyne) Vreede
Current Group Members
Visitors
Alumni
Vacancies
Research
Publications
Biomolecular simulations
Chemical reactions in complex environments
Computational Methods
Computational Polymer Chemistry and Science for Arts
Molecular Visualization
Nanoporous Materials
Soft matter
Software
Auto-martini
Hybrid MD with cm3d code
OpenPathSampling
Path-metadynamics with Plumed 2.5
pKa calculation with a proton transfer collective variable
Trace IRC
iRASPA
RASPA
Teaching
All Courses
Molsim School
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