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Recent Open Issues in Coarse Grained Force Fields
- Source :
- Journal of Chemical Information and Modeling. 60:5881-5884
- Publication Year :
- 2020
- Publisher :
- American Chemical Society (ACS), 2020.
-
Abstract
- This viewpoint intends to show recent open issues of using coarse grained models in molecular dynamics simulation. It reviews the current knowledge of the comparison between experimental and simulation data of structural and physical chemical properties that depend on the hydrophilic and hydrophobic behavior of the molecule.
- Subjects :
- Quantitative Biology::Biomolecules
010304 chemical physics
Computer science
General Chemical Engineering
General Chemistry
Molecular Dynamics Simulation
Library and Information Sciences
01 natural sciences
0104 chemical sciences
Computer Science Applications
010404 medicinal & biomolecular chemistry
Molecular dynamics
Physical chemical
0103 physical sciences
Molecule
Statistical physics
Current (fluid)
Hydrophobic and Hydrophilic Interactions
Subjects
Details
- ISSN :
- 1549960X and 15499596
- Volume :
- 60
- Database :
- OpenAIRE
- Journal :
- Journal of Chemical Information and Modeling
- Accession number :
- edsair.doi.dedup.....1293d7f27961ab2bb21125aae445e583
- Full Text :
- https://doi.org/10.1021/acs.jcim.0c01265