D
de J Jacob Vlieg
Researcher at Radboud University Nijmegen
Publications - 2
Citations - 187
de J Jacob Vlieg is an academic researcher from Radboud University Nijmegen. The author has contributed to research in topics: Virtual screening & LigandScout. The author has an hindex of 2, co-authored 2 publications receiving 151 citations.
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Data-driven medicinal chemistry in the era of big data
TL;DR: Data-driven medicinal chemistry approaches have the potential to improve decision making in drug discovery projects, providing that all researchers embrace the role of 'data scientist' and uncover the meaningful relationships and patterns in available data.
Journal ArticleDOI
From the protein's perspective: the benefits and challenges of protein structure-based pharmacophore modeling
Mpa Marijn Sanders,Ross McGuire,Luc Roumen,de Ijp Esch,de J Jacob Vlieg,Jpg Klomp,de C Graaf +6 more
TL;DR: It is demonstrated that SBPs are valuable tools for hit and lead optimization, compound library design and target hopping, especially in cases where ligand information is scarce, and can be efficiently used for virtual screening, ligand binding mode prediction, and binding site similarity detection.