Adaptive partitioning molecular dynamics using an extended Hamiltonian approach-Reference-Cited by-同舟云学术

Adaptive partitioning molecular dynamics using an extended Hamiltonian approach

Published:2021-10-14 Issue:14 Volume:155 Page:144104
ISSN:0021-9606
Container-title:The Journal of Chemical Physics
language:en
Short-container-title:J. Chem. Phys.

Author:

Bachmann Jim¹^ORCID,Doltsinis Nikos L.¹^ORCID

Affiliation:

1. Institut für Festkörpertheorie, Westfälische Wilhelms-Universität Münster and Center for Multiscale Theory and Computation, Wilhelm-Klemm-Str. 10, 48149 Münster, Germany

Funder

Westfälische Wilhelms-Universität Münster

Deutsche Forschungsgemeinschaft

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

https://aip.scitation.org/doi/pdf/10.1063/5.0059206

Reference40 articles.

1. Classical Reactive Molecular Dynamics Implementations: State of the Art

2. Hybrid molecular dynamics simulations of living filaments

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4. rs@md: Introducing Reactive Steps at the Molecular Dynamics Simulation Level

5. Theoretical studies of enzymic reactions: Dielectric, electrostatic and steric stabilization of the carbonium ion in the reaction of lysozyme

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