Eelke B Lenselink

5PUBLICATIONS
20CO-AUTHORS
Environmental biogeochemistryProteins and peptidesComputational chemistryDeep learningBiomolecular modelling and design
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Publications (5)

|Aug 24, 2023
Collaborative SAR Modeling and Prospective In Vitro Validation of Oxidative Stress Activation in Human HepG2 Cells.

Olivier J M Béquignon, Jose C Gómez-Tamayo, Eelke B Lenselink

|Jun 09, 2023
Large-Scale Modeling of Sparse Protein Kinase Activity Data.

Sohvi Luukkonen, Erik Meijer, Giovanni A Tricarico

|May 11, 2023
Enhancing Hit Discovery in Virtual Screening through Absolute Protein-Ligand Binding Free-Energy Calculations.

Wei Chen, Di Cui, Steven V Jerome

|Jul 17, 2021
Multitask machine learning models for predicting lipophilicity (logP) in the SAMPL7 challenge.

Eelke B Lenselink, Pieter F W Stouten

|Jun 17, 2020
Accurate Prediction of GPCR Ligand Binding Affinity with Free Energy Perturbation.

Francesca Deflorian, Laura Perez-Benito, Eelke B Lenselink

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