Geometry-Based versus Small-Molecule Tracking Method for Tunnel Identification: Benefits and Pitfalls
Author:
Affiliation:
1. Tunneling Group, Biotechnology Centre, Silesian University of Technology, Krzywoustego 8, 44-100 Gliwice, Poland
Funder
Narodowe Centrum Nauki
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.2c00985
Reference42 articles.
1. Software tools for identification, visualization and analysis of protein tunnels and channels
2. Gates of Enzymes
3. Substrate tunnels in enzymes: Structure-function relationships and computational methodology
4. Enzyme Tunnels and Gates As Relevant Targets in Drug Design
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