Charge-Neutral Constant pH Molecular Dynamics Simulations Using a Parsimonious Proton Buffer

Year of publication

2016

Authors

Donnini, Serena; Ullmann, R. Thomas; Groenhof, Gerrit; Grubmüller, Helmut

Organizations and authors

University of Jyväskylä

Groenhof Gerrit

Donnini Serena

Publication type

Publication format

Article

Parent publication type

Journal

Article type

Original article

Audience

Scientific

Peer-reviewed

Peer-Reviewed

MINEDU's publication type classification code

A1 Journal article (refereed), original research

Publication channel information

Journal/Series

Journal of Chemical Theory and Computation

Publisher

American Chemical Society

Volume

Issue

Pages

1040-1051

ISSN

1549-9618

Publication forum

59851

Publication forum level

Open access

Open access in the publisher’s service

Self-archived

Other information

Fields of science

Chemical sciences

Keywords

[object Object]

Publication country

United States

Internationality of the publisher

International

Language

English

International co-publication

Yes

Co-publication with a company

DOI

10.1021/acs.jctc.5b01160

The publication is included in the Ministry of Education and Culture’s Publication data collection

Yes