A consistent potential energy parameter set for lipids: dipalmitoylphosphatidylcholine as a benchmark of the GROMOS96 45A3 force field-Reference-Cited by-同舟云学术

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A consistent potential energy parameter set for lipids: dipalmitoylphosphatidylcholine as a benchmark of the GROMOS96 45A3 force field

Published:2003-01-21 Issue:1 Volume:32 Page:67-77
ISSN:0175-7571
Container-title:European Biophysics Journal
language:en
Short-container-title:Eur Biophys J

Author:

Chandrasekhar Indira,Kastenholz Mika,Lins Roberto D.,Oostenbrink Chris,Schuler Lukas D.,Tieleman D. Peter,van Gunsteren Wilfred F.

Publisher

Springer Science and Business Media LLC

Subject

General Medicine,Biophysics

Link

http://link.springer.com/content/pdf/10.1007/s00249-002-0269-4.pdf

Reference55 articles.

1. Alber F, Folkers G, Carloni P (1999) Dimethyl phosphate: stereoelectronic versus environmental effects. J Phys Chem B 103:6121–6126

2. Banavali NK, MacKerell AD Jr (2001) Reevaluation of stereoelectronic contributions to the conformational properties of the phosphodiester and N3'-phosphoramidate moieties of nucleic acids. J Am Chem Soc 123:6747–6755

3. Berendsen HJC, Postma JPM, van Gunsteren WF, Hermans J (1981) Interaction models for water in relation to protein hydration. In: Pullman B (ed) Intermolecular forces. Reidel, Dordrecht, pp 331–342

4. Berendsen HJC, Postma JPM, van Gunsteren WF, DiNola A, Haak JR (1984) Molecular dynamics with coupling to an external bath. J Chem Phys 81:3684–3690

5. Berger O, Edholm O, Jahnig F (1997) Molecular dynamics simulations of a fluid bilayer of dipalmitoylphosphatidylcholine at full hydration, constant pressure, and constant temperature. Biophys J 72:2002–2013

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