Integrating Machine Learning in the Coarse-Grained Molecular Simulation of Polymers-Reference-Cited by-同舟云学术

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Integrating Machine Learning in the Coarse-Grained Molecular Simulation of Polymers

Published:2023-03-08 Issue:11 Volume:127 Page:2302-2322
ISSN:1520-6106
Container-title:The Journal of Physical Chemistry B
language:en
Short-container-title:J. Phys. Chem. B

Author:

Ricci Eleonora¹²^ORCID,Vergadou Niki¹^ORCID

Affiliation:

1. Institute of Nanoscience and Nanotechnology, National Center for Scientific Research “Demokritos”, GR-15341 Agia Paraskevi, Athens, Greece

2. Institute of Informatics and Telecommunications, National Center for Scientific Research “Demokritos”, GR-15341 Agia Paraskevi, Athens, Greece

Publisher

American Chemical Society (ACS)

Subject

Materials Chemistry,Surfaces, Coatings and Films,Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jpcb.2c06354

Reference294 articles.

1. Hierarchical modelling of polymeric materials

2. A Review of Multiscale Computational Methods in Polymeric Materials

3. Editorial overview: Frontiers of chemical engineering: Molecular modeling

4. Understanding Molecular Simulation

Cited by 7 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. Heat-Resistant Polymer Discovery by Utilizing Interpretable Graph Neural Network with Small Data;Macromolecules;2024-04-12

2. Synthetic Force-Field Database for Training Machine Learning Models to Predict Mobility-Preserving Coarse-Grained Molecular-Simulation Potentials;Journal of Chemical Theory and Computation;2024-04-09

3. Structural Coarse-Graining via Multiobjective Optimization with Differentiable Simulation;Journal of Chemical Theory and Computation;2024-03-14

4. Monte Carlo simulations of spherocylinders interacting with site-dependent square-well potentials;Scientific Reports;2024-02-14

5. Machine Learning in Soft Matter: From Simulations to Experiments;Advanced Functional Materials;2024-01-31

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