This monograph provides a general introduction to advanced computational methods for free energy calculations, from the systematic and rigorous point of view of applied mathematics. Free energy calculations in molecular dynamics have become an outstanding and increasingly broad computational field in physics, chemistry and molecular biology within the past few years, by making possible the analysis of complex molecular systems. This work proposes a new, general and rigorous presentation, intended both for practitioners interested in a mathematical treatment, and for applied mathematicians interested in molecular dynamics.
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Lingua Inglese ● Formato PDF ● Pagine 472 ● ISBN 9781848162488 ● Dimensione 13.2 MB ● Casa editrice World Scientific Publishing Company ● Città Singapore ● Paese SG ● Pubblicato 2010 ● Scaricabile 24 mesi ● Moneta EUR ● ID 2423380 ● Protezione dalla copia Adobe DRM
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