Multiscale Dynamics Simulations - Nano and Nano-bio Systems in Complex Environments (Hardcover)

Over the past decade, great strides have been taken in developing methodologies that can treat more and more complex nano- and nano-bio systems embedded in complex environments. Multiscale Dynamics Simulations covers methods including DFT/MM-MD, DFTB and semi-empirical QM/MM-MD, DFT/MMPOL as well as Machine-learning approaches to all of the above. Focusing on key methodological breakthroughs in the field, this book provides newcomers with a comprehensive menu of multiscale modelling options so that they can better chart their course in the nano/bio world.

General

Imprint:	Royal Society of Chemistry
Country of origin:	United Kingdom
Series:	Theoretical and Computational Chemistry Series, Volume 22
Release date:	October 2021
First published:	2022
Editors:	Dennis R. Salahub • Dong-Qing Wei
Dimensions:	234 x 156mm (L x W)
Format:	Hardcover - Unsewn / adhesive bound
Pages:	388
ISBN-13:	978-1-83916-178-0
Categories:	Books > Science & Mathematics > Physics > Atomic & molecular physics Books > Computing & IT > Applications of computing > Computer modelling & simulation Books > Science & Mathematics > Chemistry > Physical chemistry > Quantum & theoretical chemistry
LSN:	1-83916-178-7
Barcode:	9781839161780

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