Atomistic Approaches in Modern Biology From Quantum Chemistry to Molecular Simulations /

• Corporate Author: SpringerLink (Online service)
• Other Authors: Reiher, Markus (Editor)
• Format: Electronic eBook
• Language: English
• Published: Berlin, Heidelberg : Springer Berlin Heidelberg, 2007.
• Series: Topics in Current Chemistry, 268
• Subjects: Chemistry.; Analytical chemistry.; Chemistry, Physical and theoretical.; Biochemistry.; Theoretical and Computational Chemistry.; Analytical Chemistry.; Biochemistry, general.

Table of Contents:

• Quantum Chemical Investigations of Reaction Paths of Metalloenzymes and Biomimetic Models – The Hydrogenase Example
• Theoretical Bioinorganic Spectroscopy
• First-Principles Approach to Vibrational Spectroscopy of Biomolecules
• Car–Parrinello Molecular Dynamics Simulations and Biological Systems
• QM/MM Methods for Biological Systems
• Transition Path Sampling Simulations of Biological Systems
• PcrA Helicase, a Molecular Motor Studied from the Electronic to the Functional Level.