Time Recovery for a Complex Process Using Accelerated Dynamics-Reference-Cited by-同舟云学术

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Time Recovery for a Complex Process Using Accelerated Dynamics

Published:2015-03-12 Issue:4 Volume:11 Page:1725-1734
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Paz S. Alexis¹²,Leiva Ezequiel P. M.¹

Affiliation:

1. INFIQC − Departamento de Matemática y Física, Facultad de Ciencias Químicas, Universidad Nacional de Córdoba, Córdoba X5000HUA, Argentina

2. Department of Chemical and Biological Engineering, Drexel University, Philadelphia, Pennsylvania 19104, United States

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/ct5009729

Reference51 articles.

1. Free Energy Calculations

2. Practical Aspects of Free-Energy Calculations: A Review

3. Potential Energy and Free Energy Landscapes

4. On-the-fly free energy parameterization via temperature accelerated molecular dynamics

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