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breed in kennis  -  sterk in techniek
Over ons Praktische zaken Waar vindt u ons W. (Willem) Jespers, Dr

Publicaties

A Structure-Based Platform for Predicting Chemical-Induced Parkinson’s Disease

Development of Indole-3-yl-methylene-thiobarbital Derivatives as Inhibitors of HDAC8 Enzyme Activity

Doing More with Less: Accurate and Scalable Ligand Free Energy Calculations by Focusing on the Binding Site

From dual norepinephrine–dopamine reuptake inhibition to selective dopamine reuptake inhibitors: a case of aromatically substituted N,2-cyclopentylamines

In silico prediction of endocrine activity

Optimisation of a Novel Class of DNA Gyrase Inhibitors to Improve Antibacterial Activity

Scaffold-based evaluation metrics for fair comparison of molecular generators

Accurate predictions of protein mutational effects accelerated with a hybrid-topology free energy protocol

In Search of Beautiful Molecules: A Perspective on Generative Modeling for Drug Design

Integrating Machine Learning into Free Energy Perturbation Workflows

Sustainable Development Goals

SDG 3 – Goede gezondheid en welzijn

Meer informatie over de Sustainable Development Goals.