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A statistical geometry analysis of simulated water-DMSO and water-MeCN binary mixtures for biomolecular studies

Water-Dimethylsulfoxide (DMSO) and water-Acetonitrile (MeCN) binary mixtures at various molar ratios ranging from 0 to 1 are studied using Molecular Dynamics (MD) simulations. Hydration properties of water in different regions of MeCN/DMSO are investigated by using the statistical geometry approach....

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Detalles Bibliográficos
Autores principales: Yadav, Neetu Singh, Choudhury, Devapriya
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Biomedical Informatics 2018
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6143356/
https://www.ncbi.nlm.nih.gov/pubmed/30262971
http://dx.doi.org/10.6026/97320630014350