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Simple Ligand–Receptor Interaction Descriptor (SILIRID) for alignment-free binding site comparison

We describe SILIRID (Simple Ligand–Receptor Interaction Descriptor), a novel fixed size descriptor characterizing protein–ligand interactions. SILIRID can be obtained from the binary interaction fingerprints (IFPs) by summing up the bits corresponding to identical amino acids. This results in a vect...

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Detalles Bibliográficos
Autores principales: Chupakhin, Vladimir, Marcou, Gilles, Gaspar, Helena, Varnek, Alexandre
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Research Network of Computational and Structural Biotechnology 2014
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4151984/
https://www.ncbi.nlm.nih.gov/pubmed/25210596
http://dx.doi.org/10.1016/j.csbj.2014.05.004