Bottom-Up Informed and Iteratively Optimized Coarse-Grained Non-Markovian Water Models with Accurate Dynamics
Author:
Affiliation:
1. Eduard-Zintl-Institut für Anorganische und Physikalische Chemie, Technische Universität Darmstadt, 64287Darmstadt, Germany
Funder
Deutsche Forschungsgemeinschaft
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry,Computer Science Applications
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.2c00871
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3. Chemically specific coarse‐graining of polymers: Methods and prospects
4. Systematic coarse-graining methods for soft matter simulations – a review
5. Multiscale modeling of soft matter: scaling of dynamics
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