Nico P E Vermeulen

3PUBLICATIONS
6CO-AUTHORS
Biomolecular modelling and designComputational chemistryMedical devices
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Publications (3)

|Nov 22, 2017
eTOX ALLIES: an automated pipeLine for linear interaction energy-based simulations.

Luigi Capoferri, Marc van Dijk, Ariën S Rustenburg

|Sep 11, 2017
Binding free energy predictions of farnesoid X receptor (FXR) agonists using a linear interaction energy (LIE) approach with reliability estimation: application to the D3R Grand Challenge 2.

Eko Aditya Rifai, Marc van Dijk, Nico P E Vermeulen

|Sep 24, 2016
Evidence-based selection of training compounds for use in the mechanism-based integrated prediction of drug-induced liver injury in man.

Sanja Dragovic, Nico P E Vermeulen, Helga H Gerets

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Frequent Collaborators

2 joint publications

Eko Aditya Rifai

2 joint publications

Marc van Dijk

2 joint publications

Daan P Geerke

1 joint publications

Ariën S Rustenburg