Format:
Online-Ressource (V, 131 p. 61 illus., 22 illus. in color, online resource)
ISBN:
9783642411632
Series Statement:
Highlights in Theoretical Chemistry 4
Content:
From the content: Preface -- Role of step sites on water dissociation on stoichiometric ceria surfaces -- Theoretical simulations of the vibrational predissociation spectra of H 5 + and D 5 + clusters -- A simple analysis of the influence of the solvent-induced electronic polarization on the 15N magnetic shielding of pyridine in water -- CompASM: an Amber-VMD alanine scanning mutagenesis plug-in
Content:
In this Festschrift dedicated to the 65th birthday of Marco Antonio Chaer Nascimento, selected researchers in theoretical chemistry present research highlights on major developments in the field. Originally published in the journal Theoretical Chemistry Accounts, these outstanding contributions are now available in a hardcover print format. This volume will be of benefit in particular to those research groups and libraries that have chosen to have only electronic access to the journal. It also provides valuable content for all researchers in theoretical chemistry
Note:
Description based upon print version of record
,
From the content: PrefaceRole of step sites on water dissociation on stoichiometric ceria surfaces -- Theoretical simulations of the vibrational predissociation spectra of H 5 + and D 5 + clusters -- A simple analysis of the influence of the solvent-induced electronic polarization on the 15N magnetic shielding of pyridine in water -- CompASM: an Amber-VMD alanine scanning mutagenesis plug-in.
Additional Edition:
ISBN 9783642411625
Additional Edition:
Erscheint auch als Druck-Ausgabe Marco Antonio Chaer Nascimento Berlin : Springer, 2014 ISBN 3642411622
Additional Edition:
ISBN 9783642411625
Language:
English
Subjects:
Chemistry/Pharmacy
Keywords:
Computational chemistry
;
Aufsatzsammlung
DOI:
10.1007/978-3-642-41163-2
URL:
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