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- Currently displaying 18461 - 18480 of 29659 publications
Can crystal structure prediction predict whether a salt or a cocrystal will be formed?
Acta Crystallographica Section A Foundations of Crystallography
(2007)
63
S163
(doi: 10.1107/S0108767307096328)
Fluctuation-dissipation ratios in the dynamics of self-assembly.
Physical Review E
(2007)
76
021119
(doi: 10.1103/PhysRevE.76.021119)
Optical Absorption of a Green Fluorescent Protein Variant: Environment Effects in a Density Functional Study
The journal of physical chemistry. B
(2007)
111
10807
(doi: 10.1021/jp072511e)
Can marcus theory be applied to redox processes in ionic liquids? A comparative simulation study of dimethylimidazolium liquids and acetonitrile
The journal of physical chemistry. B
(2007)
111
10800
(doi: 10.1021/jp074298s)
Multimodel projections of stratospheric ozone in the 21st century
Journal of Geophysical Research Atmospheres
(2007)
112
D16303
(doi: 10.1029/2006jd008332)
A sequential enantioselective, organocatalytic route to chiral 1,2-oxazines and chiral pyridazines
Org Biomol Chem
(2007)
5
2678
(doi: 10.1039/b708646f)
Natural Products as an Inspiration for the Discovery of New High‐Throughput Chemical Synthesis Tools
(2007)
2
51
(doi: 10.1002/9780470085226.ch18)
Short, Facile, and High‐Yielding Synthesis of Extremely Efficient Pincer‐Type Suzuki Catalysts Bearing Aminophosphine Substituents
Angewandte Chemie (International ed. in English)
(2007)
46
6514
(doi: 10.1002/anie.200701804)
Side effect profile prediction: Computational tackling of big pharma's worst nightmare at an early stage
ABSTR PAP AM CHEM S
(2007)
234
PHYS 342-Heterogeneous asymmetric hydrogenation of C=C bonds
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2007)
234
ENVR 154-Photoenhanced HONO production on atmospherically relevant mineral surfaces
ABSTR PAP AM CHEM S
(2007)
234
INOR 899-Electron-transfer activation of anionic ruthenium(III) anticancer drugs
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2007)
234
INOR 358-Binucleating hexaanionic cryptand ligands to engender O-O bond formation
ABSTR PAP AM CHEM S
(2007)
234
INOR 857-Supramolecular functionalization: A method to construct and decorate isoreticular metal-organic frameworks
ABSTR PAP AM CHEM S
(2007)
234
INOR 472-Synthesis and characterization of a planar tetranuclear iron(II) complex and its conversion into linear triiron and paddlewheel diiron complexes
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2007)
234
Crosslinking polymer brushes for the fabrication of quasi-2-D "micro-objects"
ABSTR PAP AM CHEM S
(2007)
234
PHYS 99-Water addition along with reduction of aqueous ruthenium complexes by ab initio free energy calculation method for bond breaking/formation coupled to electron transfer
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2007)
234
PHYS 31-Redox free energies and one-electron energy levels from density functional theory based molecular dynamics
ABSTR PAP AM CHEM S
(2007)
234
PHYS 97-Density functional based molecular dynamics simulation of the aqueous hydroxyl and thiyl radical
ABSTR PAP AM CHEM S
(2007)
234
Exploring energy landscapes with explicit and implicit water
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2007)
234