Chemical Physics, 2000, V 258, N 2-3, 15 August.

Alan K. Soper and Peter J. Rossky
Preface
107-108

 Ariel A. Chialvo, Eric Yezdimer, Thomas Driesner, Peter T.
 Cummings and J.M. Simonson
The structure of water from 25°C to 457°C: comparison between
neutron scattering and molecular simulation
109-120

 A.K. Soper
The radial distribution functions of water and ice from 220
to 673 K and at pressures up to 400 MPa    
121-137

 Michiel Sprik
Computation of the pK of liquid water using coordination
constraints  
139-150

 Yuichi Harano, Hirofumi Sato and Fumio Hirata
A theoretical study on a Diels-Alder reaction in ambient and
supercritical water: viewing solvent effects through frontier
orbitals     
151-161

 Dawne A. Yarne, Mark E. Tuckerman and Michael L. Klein
Structural and dynamical behavior of an azide anion in water
from ab initio molecular dynamics calculations   
163-169

 S. Ramos, A.C. Barnes, G.W. Neilson and M.J. Capitan
Anomalous X-ray diffraction studies of hydration effects in
concentrated aqueous electrolyte solutions 
171-180

 Igor M. Svishchev, Alexander Yu. Zassetsky and Peter G. Kusalik
Solvation structures in three dimensions
181-186

 Martin [\mbox{\v{C}}]uma, Udo W. Schmitt and Gregory A. Voth
A multi-state empirical valence bond model for acid-base
chemistry in aqueous solution  
187-199

 Gilles H. Peslherbe, Branka M. Ladanyi and James T. Hynes
Structure of NaI ion pairs in water clusters
201-224

 Sotiris S. Xantheas
Cooperativity and hydrogen bonding network in water clusters
225-231

 H.J. Bakker, S. Woutersen and H.-K. Nienhuys
Reorientational motion and hydrogen-bond stretching dynamics
in liquid water    
233-245

 J. Dawidowski, F.J. Bermejo, C. Cabrillo and S.M. Bennington
Generalized frequency spectra of water at both sides of the
freezing transition
247-255

 Martin U. Sander, Mark S. Gudiksen, Klaus Luther and Jürgen Troe
Liquid water ionization: mechanistic implications of the H/D
isotope effect in the geminate recombination of hydrated
electrons    
257-265

 Alenka Luzar
Extent of inter-hydrogen bond correlations in water.
Temperature effect 
267-276

 G.P. Johari
On the origin of the heat capacity feature of annealed ices
and ice clathrates, and interpreting water's diffusivity in
terms of the entropy     
277-290

 R. Scott Smith, Z. Dohnálek, Greg A. Kimmel, K.P. Stevenson and
 Bruce D. Kay
The self-diffusivity of amorphous solid water near 150 K     
291-305

 Francesco Sciortino
Slow dynamics in supercooled water
307-314

 S. Dellerue and M.-C. Bellissent-Funel
Relaxational dynamics of water molecules at protein surface
315-325

 John Dore
Structural studies of water in confined geometry by neutron
diffraction  
327-347

 G. Hummer, S. Garde, A.E. García and L.R. Pratt
New perspectives on hydrophobic effects
349-370

 Akihiro Morita and James T. Hynes
A theoretical analysis of the sum frequency generation
spectrum of the water surface  
371-390

 Arthur Pichler et al.
The role of water in B-DNAs BI to BII conformer substates
interconversion: a combined study by calorimetry, FT-IR 
spectroscopy and computer simulation
391-404

 Gillian C. Lynch and B. Montgomery Pettitt
Semi-grand canonical molecular dynamics simulation of bovine
pancreatic trypsin inhibitor   
405-413

 Christina Carey, Yuen-Kit Cheng and Peter J. Rossky
Hydration structure of the [alpha]-chymotrypsin substrate
binding pocket: the impact of constrained geometry     
415-425

 George E. Walrafen and Yuan-Chao Chu
Nature of collagen-water hydration forces: a problem in water
structure    
427-446

Index
447-450

Index
451-460