A practical guide to biologically relevant molecular simulations with charge scaling for electronic polarization-Reference-Cited by-同舟云学术

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A practical guide to biologically relevant molecular simulations with charge scaling for electronic polarization

Published:2020-08-07 Issue:5 Volume:153 Page:050901
ISSN:0021-9606
Container-title:The Journal of Chemical Physics
language:en
Short-container-title:J. Chem. Phys.

Author:

Duboué-Dijon E.¹²^ORCID,Javanainen M.³^ORCID,Delcroix P.³^ORCID,Jungwirth P.³^ORCID,Martinez-Seara H.³^ORCID

Affiliation:

1. CNRS, Université de Paris, UPR 9080, Laboratoire de Biochimie Théorique, 13 rue Pierre et Marie Curie, 75005 Paris, France

2. Institut de Biologie Physico-Chimique-Fondation Edmond de Rothschild, PSL Research University, Paris, France

3. Institute of Organic Chemistry and Biochemistry, Czech Academy of Sciences, Flemingovo nam. 2, Prague 6 166 10, Czech Republic

Funder

Initiative d’Excellence

Czech Science Foundation

OP RDE

Emil Aaltosen Säätiö

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://aip.scitation.org/doi/pdf/10.1063/5.0017775

Reference128 articles.

1. Calcium Signaling

2. Structures and metal-ion-binding properties of the Ca2+-binding helix–loop–helix EF-hand motifs

3. Electronic Continuum Model for Molecular Dynamics Simulations of Biological Molecules

4. Calcium Binding to Calmodulin by Molecular Dynamics with Effective Polarization

5. Binding of Divalent Cations to Insulin: Capillary Electrophoresis and Molecular Simulations

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