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GenIce: Hydrogen‐Disordered Ice Generator

GenIce is an efficient and user‐friendly tool to generate hydrogen‐disordered ice structures. It makes ice and clathrate hydrate structures in various file formats. More than 100 kinds of structures are preset. Users can install their own crystal structures, guest molecules, and file formats as plug...

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Detalhes bibliográficos
Publicado no:J Comput Chem
Main Authors: Matsumoto, Masakazu, Yagasaki, Takuma, Tanaka, Hideki
Formato: Artigo
Idioma:Inglês
Publicado em: John Wiley and Sons Inc. 2017
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC5725672/
https://ncbi.nlm.nih.gov/pubmed/29023825
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/jcc.25077
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