Simu-D: A Simulator-Descriptor Suite for Polymer-Based Systems under Extreme Conditions

We present Simu-D, a software suite for the simulation and successive identification of local structures of atomistic systems, based on polymers, under extreme conditions, in the bulk, on surfaces, and at interfaces. The protocol is built around various types of Monte Carlo algorithms, which include...

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Detalles Bibliográficos
Autores principales: Herranz, Miguel, Martínez-Fernández, Daniel, Ramos, Pablo Miguel, Foteinopoulou, Katerina, Karayiannis, Nikos Ch., Laso, Manuel
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2021
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8621175/
https://www.ncbi.nlm.nih.gov/pubmed/34830346
http://dx.doi.org/10.3390/ijms222212464

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8621175/
https://www.ncbi.nlm.nih.gov/pubmed/34830346
http://dx.doi.org/10.3390/ijms222212464

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