Browsing Centro Académico de Salud (CAS) by Author "Scardino, Valeria."
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Combination of pose and rank consensus in docking-based virtual screening: the best of both worlds
Cavasotto, Claudio.; Scardino, Valeria.; Bollini, Mariela. (Royal Society of Chemistry, 2021-11)Abstract The use of high-throughput docking (HTD) in the drug discovery pipeline is today widely established. In spite of methodological improvements in docking accuracy (pose prediction), scoring power, ranking power, ...