Free energy computations: a mathematical perspective
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 i...
Gespeichert in:
| Beteilige Person: | |
|---|---|
| Format: | Elektronisch E-Book |
| Sprache: | Englisch |
| Veröffentlicht: |
London
Imperial College Press
c2010
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| Schlagwörter: | |
| Links: | http://www.worldscientific.com/worldscibooks/10.1142/P579#t=toc http://www.worldscientific.com/worldscibooks/10.1142/P579#t=toc |
| Zusammenfassung: | 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 |
| Umfang: | xii, 458 p. ill |
| ISBN: | 9781848162488 |
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| dewey-tens | 530 - Physics |
| discipline | Physik |
| format | Electronic eBook |
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| id | DE-604.BV044633374 |
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| institution | BVB |
| isbn | 9781848162488 |
| language | English |
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| spelling | Lelievre, Tony Verfasser aut Free energy computations a mathematical perspective Tony Lelievre, Mathias Rousset, Gabriel Stoltz London Imperial College Press c2010 xii, 458 p. ill txt rdacontent c rdamedia cr rdacarrier 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 Gibbs' free energy Statistical physics / Mathematical models Freie Energie (DE-588)4155282-9 gnd rswk-swf Numerisches Verfahren (DE-588)4128130-5 gnd rswk-swf Freie Energie (DE-588)4155282-9 s Numerisches Verfahren (DE-588)4128130-5 s 1\p DE-604 Rousset, Mathias 1980- Sonstige oth Stoltz, Gabriel Sonstige oth Erscheint auch als Druck-Ausgabe 1848162472 (hbk.) Erscheint auch als Druck-Ausgabe 9781848162471 (hbk.) http://www.worldscientific.com/worldscibooks/10.1142/P579#t=toc Verlag URL des Erstveroeffentlichers Volltext 1\p cgwrk 20201028 DE-101 https://d-nb.info/provenance/plan#cgwrk |
| spellingShingle | Lelievre, Tony Free energy computations a mathematical perspective Gibbs' free energy Statistical physics / Mathematical models Freie Energie (DE-588)4155282-9 gnd Numerisches Verfahren (DE-588)4128130-5 gnd |
| subject_GND | (DE-588)4155282-9 (DE-588)4128130-5 |
| title | Free energy computations a mathematical perspective |
| title_auth | Free energy computations a mathematical perspective |
| title_exact_search | Free energy computations a mathematical perspective |
| title_full | Free energy computations a mathematical perspective Tony Lelievre, Mathias Rousset, Gabriel Stoltz |
| title_fullStr | Free energy computations a mathematical perspective Tony Lelievre, Mathias Rousset, Gabriel Stoltz |
| title_full_unstemmed | Free energy computations a mathematical perspective Tony Lelievre, Mathias Rousset, Gabriel Stoltz |
| title_short | Free energy computations |
| title_sort | free energy computations a mathematical perspective |
| title_sub | a mathematical perspective |
| topic | Gibbs' free energy Statistical physics / Mathematical models Freie Energie (DE-588)4155282-9 gnd Numerisches Verfahren (DE-588)4128130-5 gnd |
| topic_facet | Gibbs' free energy Statistical physics / Mathematical models Freie Energie Numerisches Verfahren |
| url | http://www.worldscientific.com/worldscibooks/10.1142/P579#t=toc |
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