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A. Beatriz Garmendia-Doval
Publications - 4
Citations - 392
A. Beatriz Garmendia-Doval is an academic researcher. The author has contributed to research in topics: Virtual screening & Genetic programming. The author has an hindex of 4, co-authored 4 publications receiving 319 citations.
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Journal ArticleDOI
rDock: A Fast, Versatile and Open Source Program for Docking Ligands to Proteins and Nucleic Acids
Sergio Ruiz-Carmona,Daniel Alvarez-Garcia,Nicolas Foloppe,A. Beatriz Garmendia-Doval,Szilveszter Juhos,Peter Schmidtke,Xavier Barril,Roderick E. Hubbard,S. David Morley +8 more
TL;DR: The rDock as discussed by the authors is a molecular docking program developed at Vernalis for high-throughput virtual screening (HTVS) applications, which can be used against proteins and nucleic acids, and allows the user to incorporate additional constraints and information as a bias to guide docking.
Book ChapterDOI
Post Docking Filtering Using Cartesian Genetic Programming
TL;DR: The results of initial attempts to automate the removal of false positives from virtual hit sets, by evolving a post docking filter using Cartesian Genetic Programming are presented.
Book ChapterDOI
Cartesian Genetic Programming and the Post Docking Filtering Problem
TL;DR: This chapter presents the automated removal of false positives from virtual hit sets, by evolving a post docking filter using Cartesian Genetic Programming (CGP), and investigates characteristics of CGP for this problem and confirms the absence of bloat and the usefulness of neutral drift.
Journal Article
Post docking filtering using cartesian genetic programming
TL;DR: In this article, the authors presented the results of initial attempts to automate the removal of false positives from virtual hit sets, by evolving a post docking filter using Cartesian Genetic Programming.