Wenbo Yu

Scopus Author ID Scopus Author ID ORCID

Publication Activity (10 Years)

Years Active: 2020-2024
Publications (10 Years): 9

Top Topics

Molecular Dynamics Simulations

Density Functional Theory

Protein Protein

Top Venues

The journal of physical chemistry. B

Journal of chemical theory and computation

Proceedings of the National Academy of Sciences of the United States of America

Drug design, development and therapy

This page only lists publications with an associated author ORCID identifier.

Publications

Mingtian Zhao, Wenbo Yu, Alexander D MacKerell
Enhancing SILCS-MC via GPU Acceleration and Ligand Conformational Optimization with Genetic and Parallel Tempering Algorithms. The journal of physical chemistry. B 128 (30) (2024)
Mingtian Zhao, Wenbo Yu, Alexander D MacKerell
Enhancing SILCS-MC via GPU Acceleration and Ligand Conformational Optimization with Genetic and Parallel Tempering Algorithms. The journal of physical chemistry. B 128 (30) (2024)
Mingtian Zhao, Wenbo Yu, Alexander D MacKerell
Enhancing SILCS-MC via GPU Acceleration and Ligand Conformational Optimization with Genetic and Parallel Tempering Algorithms. The journal of physical chemistry. B 128 (30) (2024)
Mingtian Zhao, Wenbo Yu, Alexander D MacKerell
Enhancing SILCS-MC via GPU Acceleration and Ligand Conformational Optimization with Genetic and Parallel Tempering Algorithms. The journal of physical chemistry. B (2024)
Wenbo Yu, David J Weber, Alexander D MacKerell
Integrated Covalent Drug Design Workflow Using Site Identification by Ligand Competitive Saturation. Journal of chemical theory and computation 19 (10) (2023)
Wenbo Yu, David J Weber, Alexander D MacKerell
Integrated Covalent Drug Design Workflow Using Site Identification by Ligand Competitive Saturation. Journal of chemical theory and computation (2023)
Brianna D Young, Wenbo Yu, Darex J Vera Rodríguez, Kristen M Varney, Alexander D MacKerell, David J Weber
Specificity of Molecular Fragments Binding to S100B versus S100A1 as Identified by NMR and Site Identification by Ligand Competitive Saturation (SILCS). Molecules (Basel, Switzerland) 26 (2) (2021)
Stuart M Weston, Lauren Baracco, Chloe Keller, Krystal Matthews, Marisa E McGrath, James P Logue, Janie Liang, Julie Dyall, Michael R Holbrook, Lisa E Hensley, Peter B Jahrling, Wenbo Yu, Alexander D MacKerell, Matthew B Friemann
The SKI complex is a broad-spectrum, host-directed antiviral drug target for coronaviruses, influenza, and filoviruses. Proceedings of the National Academy of Sciences of the United States of America 117 (48) (2020)
Jay Chauhan, Wenbo Yu, Steven Cardinale, Timothy J Opperman, Alexander D MacKerell, Steven Fletcher, Erik Ph de Leeuw
Optimization of a Benzothiazole Indolene Scaffold Targeting Bacterial Cell Wall Assembly. Drug design, development and therapy 14 (2020)