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Contents list for Physical Chemistry Chemical Physics, issue 45, 2006
Front cover
Phys. Chem. Chem. Phys., 2006, 8, 5257
DOI: 10.1039/b615916h
Inside front cover
Phys. Chem. Chem. Phys., 2006, 8, 5258
DOI: 10.1039/b615917f
Contents
Phys. Chem. Chem. Phys., 2006, 8, 5259
DOI: 10.1039/b615919m
Invited Article
Interaction of proteins with linear polyelectrolytes and spherical polyelectrolyte brushes in aqueous solution
A. Wittemann and M. Ballauff,
Phys. Chem. Chem. Phys., 2006, 8, 5269
DOI: 10.1039/b609879g
Papers
Ab initio and AIM theoretical analysis of hydrogen-bond radius of HD (D = F, Cl, Br, CN, HO, HS and CCH) donors and some acceptors
B. Raghavendra, Pankaj K. Mandal and E. Arunan,
Phys. Chem. Chem. Phys., 2006, 8, 5276
DOI: 10.1039/b611033a
Density functional theory including dispersion corrections for intermolecular interactions in a large benchmark set of biologically relevant molecules
Jens Antony and Stefan Grimme,
Phys. Chem. Chem. Phys., 2006, 8, 5287
DOI: 10.1039/b612585a
Photoinduced electron transfer sensitization investigated by chemically induced dynamic nuclear polarizatioin (CIDNP)
Martin Goez and Gerd Eckert,
Phys. Chem. Chem. Phys., 2006, 8, 5294
DOI: 10.1039/b609026e
Exploration of the potential energy surface of C4H4 for rearrangement and decomposition reactions of vinylacetylene: A computational study. Part I
Dieter Cremer, Elfriede Kraka, Hyun Joo, Jaime A. Stearns and Timothy S. Zwier,
Phys. Chem. Chem. Phys., 2006, 8, 5304
DOI: 10.1039/b609284e
Experimental and computational study of the ultraviolet photolysis of vinylacetylene. Part II.
Jaime A. Stearns, Timothy S. Zwier, Elfriede Kraka and Dieter Cremer,
Phys. Chem. Chem. Phys., 2006, 8, 5317
DOI: 10.1039/b609285c
Branching ratios for quenching of nitric oxide A 2
+(
= 0) to X 2
(
= 0)
Thomas B. Settersten, Brian D. Patterson, Helmut Kronemayer, Volker Sick, Christof Schulz and John W. Daily,
Phys. Chem. Chem. Phys., 2006, 8, 5328
DOI: 10.1039/b608619e
Stepwise conformational cooling towards a single isomeric state in the four internal rotors system 1,2-butanediol
Igor D. Reva, António J. Lopes Jesus, Mário T. S. Rosado, Rui Fausto, M. Ermelinda Eusébio and J. S. Redinha,
Phys. Chem. Chem. Phys., 2006, 8, 5339
DOI: 10.1039/b610962d
The p-type conduction mechanism in Cu2O: a first principles study
Michael Nolan and Simon D. Elliott,
Phys. Chem. Chem. Phys., 2006, 8, 5350
DOI: 10.1039/b611969g
Redox competition mode of scanning electrochemical microscopy (RC-SECM) for visualisation of local catalytic activity
Kathrin Eckhard, Xingxing Chen, Florin Turcu and Wolfgang Schuhmann,
Phys. Chem. Chem. Phys., 2006, 8, 5359
DOI: 10.1039/b609511a
Comments
Comment on 
Molecular dynamics DFT:B3LYP study of guanosinetriphosphate conversion into guanosinemonophosphate upon Mg2+ chelation of 
and 
phosphate oxygens of the triphosphate tail
by Alexander A. Tulub, Phys. Chem. Chem. Phys., 2006, 8, 2187
Jeremy N. Harvey, Jolanta 
urek, Ulla Pentikäinen and Adrian J. Mulholland,
Phys. Chem. Chem. Phys., 2006, 8, 5366
DOI: 10.1039/b608855d
Reply to the 
Comment on Molecular dynamics DFT:B3LYP study of guanosinetriphosphate conversion into guanosinemonophosphate upon Mg2+ chelation of and phosphate oxygens of the triphosphate tail
by Jeremy N. Harvey, Jolanta urek, Ulla Pentikäinen and Adrian J. Mulholland, Phys. Chem. Chem. Phys., 2006, DOI: 10.1039/b608855d
Alexander A. Tulub,
Phys. Chem. Chem. Phys., 2006, 8, 5368
DOI: 10.1039/b609671a
Back matter
Phys. Chem. Chem. Phys., 2006, 8, 5370
DOI: 10.1039/b615920f
Back cover
Phys. Chem. Chem. Phys., 2006, 8, 5371
DOI: 10.1039/b615921b
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