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- Currently displaying 20481 - 20500 of 29634 publications
Archetypal energy landscapes: Dynamical diagnosis
The Journal of Chemical Physics
(2004)
122
024103
(doi: 10.1063/1.1829633)
Investigating the Effects of Mutations on Protein Aggregation in the Cell*
Journal of Biological Chemistry
(2004)
280
10607
(doi: 10.1074/jbc.M412951200)
The influence of temperature and density functional models in ab initio molecular dynamics simulation of liquid water - art. no. 014515
The Journal of Chemical Physics
(2004)
122
014515
(doi: 10.1063/1.1828433)
A low cost instrument based on a solid state sensor for balloon-borne atmospheric O3 profile sounding
J Environ Monit
(2004)
7
158
(doi: 10.1039/b412184h)
Density functional calculation of the electronic absorption spectrum of Cu+ and Ag+ aqua ions
The Journal of Chemical Physics
(2004)
121
11885
(doi: 10.1063/1.1818676)
Synthesis and Structure Determination of a New Organically Templated Scandium Fluorophosphate Framework and Its Indium Analogue
Chemistry of Materials
(2004)
16
5350
(doi: 10.1021/cm048764r)
The energy landscape as a unifying theme in molecular science.
Phil. Trans. Roy. Soc. A
(2004)
363
357-377
(doi: 10.1098/rsta.2004.1497)
Line strengths and transition dipole moment of the ν2 fundamental band of the methyl radical
The Journal of Chemical Physics
(2004)
122
14306
(doi: 10.1063/1.1812755)
Resolution of (S,S)-4-(2,2,4-trimethyl-chroman-4-yl)phenyl camphanate and its 4-chromanyl epimer by crystallization
Acta Crystallogr C
(2004)
61
o32
(doi: 10.1107/s0108270104029671)
Scientific biography - Nicholas Charles Handy
Molecular Physics
(2004)
102
2395
(doi: 10.1080/00268970412331303750)
The Molecular Physics Lecture 2004: (i) Density Functional Theory, (ii) Quantum Monte Carlo
Molecular Physics
(2004)
102
2399
(doi: 10.1080/00268970412331293848)
Speed-up of Monte Carlo simulations by sampling of rejected states.
Proceedings of the National Academy of Sciences of the United States of America
(2004)
101
17571
(doi: 10.1073/pnas.0407950101)
The Hydrophobic Effect as a Driving Force in the Self‐Assembly of a [2×2] Copper(I) Grid
Angewandte Chemie
(2004)
116
6892
(doi: 10.1002/ange.200461308)
The hydrophobic effect as a driving force in the self-assembly of a [2x2] Copper(I) grid
Angewandte Chemie International Edition
(2004)
43
6724
(doi: 10.1002/anie.200461308)
What Is the Smallest Saturated Acyclic Alkane that Cannot Be Made?.
Journal of chemical information and modeling
(2004)
45
81
(doi: 10.1021/ci0497657)
Reactions of potent antitumor complex trans-[(RuCl4)-Cl-III(indazole)(2)](-)with a DNA-relevant nucleobase and thioethers: Insight into biological action
Inorganic chemistry
(2004)
44
122
(doi: 10.1021/ic048967h)
Molecular dynamics simulations of GlpF in a micelle vs in a bilayer: conformational dynamics of a membrane protein as a function of environment.
The Journal of Physical Chemistry B
(2004)
109
575
(doi: 10.1021/jp046727h)
Total synthesis of the Fusarium toxin equisetin
Organic & biomolecular chemistry
(2004)
3
274
(doi: 10.1039/b411350k)
Adsorption of atmospherically relevant gases at the air/water interface: Free energy profiles of aqueous solvation of N2, O2, O3, OH, H2O, HO2, and H2O2
The Journal of Physical Chemistry A
(2004)
108
11573
(doi: 10.1021/jp046268k)
