How well do force fields capture the strength of salt bridges in proteins?

Mustapha Carab Hussein Ahmed; Elena Papaleo; Kresten Lindorff-Larsen

doi:10.7717/peerj.4967

How well do force fields capture the strength of salt bridges in proteins?

Mustapha Carab Hussein Ahmed, Elena Papaleo, Kresten Lindorff-Larsen

19 Citations (Scopus)

69 Downloads (Pure)

Original language	English
Article number	4967
Journal	PeerJ
Volume	6
Number of pages	17
ISSN	2167-8359
DOIs	https://doi.org/10.7717/peerj.4967
Publication status	Published - 2018

Keywords

Salt bridge
Molecular dynamics
Protein chemistry
Force field
NMR
Protein electrostatics

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10.7717/peerj.4967Licence: CC BY

How well do force fields capture the strength of salt bridges in proteinsFinal published version, 4.31 MBLicence: CC BY

Cite this

@article{fd4ca005a44149e3b8e1cc65aac42bd1,

title = "How well do force fields capture the strength of salt bridges in proteins?",

keywords = "Salt bridge, Molecular dynamics, Protein chemistry, Force field, NMR, Protein electrostatics",

author = "Ahmed, {Mustapha Carab Hussein} and Elena Papaleo and Kresten Lindorff-Larsen",

year = "2018",

doi = "10.7717/peerj.4967",

language = "English",

volume = "6",

journal = "PeerJ",