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Cited by 1,206

The DOI matches its Crossref record; 85 of the 85 references it cites were found in a registry or an index.

Lipid14: The Amber Lipid Force Field

Open access
Dickson, Callum J., Madej, Benjamin D., Skjevik, Åge A., Betz, Robin M., Teigen, Knut, Gould, Ian R., Walker, Ross C.·2014·Journal of Chemical Theory and Computation
DOI 10.1021/ct4010307
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Abstract

The AMBER lipid force field has been updated to create Lipid14, allowing tensionless simulation of a number of lipid types with the AMBER MD package. The modular nature of this force field allows numerous combinations of head and tail groups to create different lipid types, enabling the easy insertion of new lipid species. The Lennard-Jones and torsion parameters of both the head and tail groups have been revised and updated partial charges calculated. The force field has been validated by simulating bilayers of six different lipid types for a total of 0.5 μs each without applying a surface tension; with favorable comparison to experiment for properties such as area per lipid, volume per lipid, bilayer thickness, NMR order parameters, scattering data, and lipid lateral diffusion. As the derivation of this force field is consistent with the AMBER development philosophy, Lipid14 is compatible with the AMBER protein, nucleic acid, carbohydrate, and small molecule force fields.

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Metadata

Authors
Dickson, C. J., Madej, B. D., Skjevik, Å. A., Betz, R. M., Teigen, K., Gould, I. R., & Walker, R. C.
Venue
Journal of Chemical Theory and Computation
Publisher
American Chemical Society (ACS)
Published
2014-01-30
Volume
10
Issue
2
Pages
865-879
ISSN
  • 1549-9618 (ISSN-L)
  • 1549-9626
DOI
10.1021/ct4010307
OpenAlex
W2323104785
Cited by
1,206
References
85
FWCI
24.70
Type
journal article
Language
en
Open access
hybrid

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