☰ Chemistry Tree

Gerard JP van Westen

Affiliations:

Leiden University, Leiden, Netherlands

Area:

computational drug discovery, cheminformatics, medicinal chemistry, bioinformatics, proteochemometrics

Website:

http://www.gjpvanwesten.nl/

Google:

"Gerard JP van Westen"

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Parents

Andreas Bender	grad student	2007-2012
Ad P. IJzerman	grad student	2007-2012
Herman W. T. van Vlijmen	grad student	2007-2012	Leiden
John Overington	post-doc	2012-2015	EMBL-EBI (Computational Biology Tree)

Children

Collaborators

Huib Ovaa	collaborator	2015-	LUMC
Mario van der Stelt	collaborator	2015-	Leiden

BETA: Related publications

Publications

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Qin T, Prins S, Groeneveld GJ, et al. (2020) Utility of Animal Models to Understand Human Alzheimer's Disease, Using the Mastermind Research Approach to Avoid Unnecessary Further Sacrifices of Animals. International Journal of Molecular Sciences. 21
He J, McLaughlin RP, van der Noord V, et al. (2019) Multi-targeted kinase inhibition alleviates mTOR inhibitor resistance in triple-negative breast cancer. Breast Cancer Research and Treatment
Paricharak S, Méndez-Lucio O, Chavan Ravindranath A, et al. (2016) Data-driven approaches used for compound library design, hit triage and bioactivity modeling in high-throughput screening. Briefings in Bioinformatics
Lenselink EB, Jespers W, van Vlijmen HW, et al. (2016) Interacting with GPCRs: Using Interaction Fingerprints for Virtual Screening. Journal of Chemical Information and Modeling. 56: 2053-2060
Christmann-Franck S, van Westen GJ, Papadatos G, et al. (2016) Unprecedently Large-Scale Kinase Inhibitor Set Enabling the Accurate Prediction of Compound–Kinase Activities: A Way toward Selective Promiscuity by Design? Journal of Chemical Information and Modeling. 26: 1654-1675
Hebels DG, Rasche A, Herwig R, et al. (2016) A Systems Biology Approach for Identifying Hepatotoxicant Groups Based on Similarity in Mechanisms of Action and Chemical Structure. Methods in Molecular Biology (Clifton, N.J.). 1425: 339-59
Cortés-Ciriano I, van Westen GJ, Bouvier G, et al. (2015) Improved large-scale prediction of growth inhibition patterns using the NCI60 cancer cell line panel. Bioinformatics (Oxford, England)
Murrell DS, Cortes-Ciriano I, van Westen GJ, et al. (2015) Chemically Aware Model Builder (camb): an R package for property and bioactivity modelling of small molecules. Journal of Cheminformatics. 7: 45
Gaulton A, Kale N, van Westen GJ, et al. (2015) A large-scale crop protection bioassay data set. Scientific Data. 2: 150032
Mugumbate G, Abrahams KA, Cox JA, et al. (2015) Mycobacterial dihydrofolate reductase inhibitors identified using chemogenomic methods and in vitro validation. Plos One. 10: e0121492

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