Deep neural networks for pose validation, affinity prediction, and input attribution

<p>The search for drug molecules which bind strongly to specific proteins is an integral part of the drug discovery process. To this end, virtual screening algorithms which aim to screen a large number of potential binders in silico have been developed. These use scoring functions to assess th...

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Bibliographic Details
Main Author: Scantlebury, J
Other Authors: Deane, C
Format: Thesis
Language:English
Published: 2023
Subjects: