How Do Small Molecule Aggregates Inhibit Enzyme Activity? A Molecular Dynamics Study
Author:
Affiliation:
1. College of Pharmacy, Al Ain University, Abu Dhabi, United Arab Emirates
2. Division of Pharmacy and Optometry, School of Health Sciences, University of Manchester, Oxford Road, Manchester M13 9PL, United Kingdom
Publisher
American Chemical Society (ACS)
Subject
Library and Information Sciences,Computer Science Applications,General Chemical Engineering,General Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jcim.0c00540
Reference48 articles.
1. A High-Throughput Screen for Aggregation-Based Inhibition in a Large Compound Library
2. A detergent-based assay for the detection of promiscuous inhibitors
3. Internal Structure and Preferential Protein Binding of Colloidal Aggregates
4. Promiscuous Aggregate-Based Inhibitors Promote Enzyme Unfolding
5. A Common Mechanism Underlying Promiscuous Inhibitors from Virtual and High-Throughput Screening
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