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

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

19 Citationer (Scopus)

69 Downloads (Pure)

Originalsprog	Engelsk
Artikelnummer	4967
Tidsskrift	PeerJ
Vol/bind	6
Antal sider	17
ISSN	2167-8359
DOI	https://doi.org/10.7717/peerj.4967
Status	Udgivet - 2018

Adgang til dokumentet

10.7717/peerj.4967Licens: CC BY

How well do force fields capture the strength of salt bridges in proteinsForlagets udgivne version, 4,31 MBLicens: CC BY

Citationsformater

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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",

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T1 - How well do force fields capture the strength of salt bridges in proteins?

AU - Ahmed, Mustapha Carab Hussein

AU - Papaleo, Elena

AU - Lindorff-Larsen, Kresten

PY - 2018

Y1 - 2018

KW - Salt bridge

KW - Molecular dynamics

KW - Protein chemistry

KW - Force field

KW - NMR

KW - Protein electrostatics

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DO - 10.7717/peerj.4967

M3 - Journal article

C2 - 29910983

SN - 2167-8359

VL - 6

JO - PeerJ

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