Comparing an All-Atom and a Coarse-Grained Description of Lipid Bilayers in Terms of Enthalpies and Entropies: From MD Simulations to 2D Lattice Models-Reference-Cited by-同舟云学术

Comparing an All-Atom and a Coarse-Grained Description of Lipid Bilayers in Terms of Enthalpies and Entropies: From MD Simulations to 2D Lattice Models

Published:2019-10-08 Issue:11 Volume:15 Page:6393-6402
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Hakobyan Davit¹²^ORCID,Heuer Andreas¹²

Affiliation:

1. Institute of Physical Chemistry, WWU Muenster, Corrensstr. 28/30, 48149 Muenster, Germany

2. Center for Multiscale Theory and Computation (CMTC), WWU Muenster, 48149 Muenster, 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.9b00390

Reference51 articles.

1. Update of the CHARMM All-Atom Additive Force Field for Lipids: Validation on Six Lipid Types

2. Refined OPLS All-Atom Force Field for Saturated Phosphatidylcholine Bilayers at Full Hydration

3. Biomolecular simulations of membranes: Physical properties from different force fields

4. United atom force field for phospholipid membranes: Constant pressure molecular dynamics simulation of dipalmitoylphosphatidicholine/water system

5. Molecular dynamics simulations of a fluid bilayer of dipalmitoylphosphatidylcholine at full hydration, constant pressure, and constant temperature

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