Open Access
Editorial
Editorial - Constraints: From physical principles to molecular simulations and beyond p. 1
Published online: 13 December 2011
DOI: 10.1140/epjst/e2011-01516-x
The European Physical Journal Special Topics
Volume 200 (November II 2011)
Constraints: From Physical Principles to Molecular Simulations and Beyond
Review
The canonical equilibrium of constrained molecular models p. 5
Published online: 13 December 2011
DOI: 10.1140/epjst/e2011-01517-9
Corrected potential energy functions for constrained molecular dynamics p. 55
Published online: 13 December 2011
DOI: 10.1140/epjst/e2011-01518-8
Review
On two possible definitions of the free energy for collective variables p. 73
Published online: 13 December 2011
DOI: 10.1140/epjst/e2011-01519-7
Review
Constraint methods for determining pathways and free energy of activated processes p. 91
Published online: 13 December 2011
DOI: 10.1140/epjst/e2011-01520-2
Coarse-graining stiff bonds p. 107
Published online: 13 December 2011
DOI: 10.1140/epjst/e2011-01521-1
Stochastic-dynamical thermostats for constraints and stiff restraints p. 131
Published online: 13 December 2011
DOI: 10.1140/epjst/e2011-01522-0
Review
Ambient space formulations and statistical mechanics of holonomically constrained Langevin systems p. 153
Published online: 13 December 2011
DOI: 10.1140/epjst/e2011-01523-y
Review
Constrained molecular dynamics in the isothermal-isobaric ensemble and its adaptation for adiabatic free energy dynamics p. 183
Published online: 13 December 2011
DOI: 10.1140/epjst/e2011-01524-x
Review
SHAKE parallelization p. 211
Published online: 13 December 2011
DOI: 10.1140/epjst/e2011-01525-9
Review
Constrained macromolecular chains at thermal equilibrium: A quantum-mechanical approach p. 225
Published online: 13 December 2011
DOI: 10.1140/epjst/e2011-01526-8
Review
On the use of slow manifolds in molecular and geophysical fluid dynamics p. 259
Published online: 13 December 2011
DOI: 10.1140/epjst/e2011-01527-7
