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List of works by Nils Weskamp

Clustering of gene expression data using a local shape-based similarity measure

scientific article

Coloring Molecules with Explainable Artificial Intelligence for Preclinical Relevance Assessment

scientific article published on 19 November 2020

Efficient similarity search in protein structure databases by k-clique hashing.

scientific article

Exploration of structure-activity relationship determinants in analogue series

scientific article published in May 2009

From the similarity analysis of protein cavities to the functional classification of protein families using cavbase

scientific article published on 25 April 2006

Functional classification of protein kinase binding sites using Cavbase

scientific article published on 01 October 2007

Guided Iterative Substructure Search (GI-SSS) - A New Trick for an Old Dog.

scientific article published on 12 July 2016

Matched Peptides: Tuning Matched Molecular Pair Analysis for Biopharmaceutical Applications

scientific article

Merging chemical and biological space: Structural mapping of enzyme binding pocket space

scientific article published in August 2009

Multiple graph alignment for the structural analysis of protein active sites

scientific article published in April 2007

SAR matrices: automated extraction of information-rich SAR tables from large compound data sets

scientific article

Strategies to search and design stabilizers of protein-protein interactions: a feasibility study

scientific article

Structure-activity relationship anatomy by network-like similarity graphs and local structure-activity relationship indices

scientific article published on 18 September 2008

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