Dowker complex based machine learning (DCML) models for protein-ligand binding affinity prediction.

With the great advancements in experimental data, computational power and learning algorithms, artificial intelligence (AI) based drug design has begun to gain momentum recently. AI-based drug design has great promise to revolutionize pharmaceutical industries by significantly reducing the time and...

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Bibliographic Details
Main Authors: Xiang Liu, Huitao Feng, Jie Wu, Kelin Xia
Format: Article
Language:English
Published: Public Library of Science (PLoS) 2022-04-01
Series:PLoS Computational Biology
Online Access:https://doi.org/10.1371/journal.pcbi.1009943