Computational Modeling of Molecular Mechanics for the Experimentally Inclined
Author:
Affiliation:
1. Department of NanoEngineering, University of California, San Diego 9500 Gilman Drive, Mail Code 0448, La Jolla, California 92093-0448, United States
Funder
Air Force Office of Scientific Research
Achievement Rewards for College Scientists Foundation
Division of Materials Research
Publisher
American Chemical Society (ACS)
Subject
Materials Chemistry,General Chemical Engineering,General Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.chemmater.2c00292
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3. Computational Prediction of Protein-Protein Interactions
4. Combining Molecular Dynamics and Machine Learning to Predict Self-Solvation Free Energies and Limiting Activity Coefficients
5. MoSDeF, a Python Framework Enabling Large-Scale Computational Screening of Soft Matter: Application to Chemistry-Property Relationships in Lubricating Monolayer Films
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