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- Currently displaying 19121 - 19140 of 30393 publications
Side effect profile prediction: Computational tackling of big pharma's worst nightmare at an early stage
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2007)
234
ORGN 121-Toward the total synthesis of azadirachtin
ABSTR PAP AM CHEM S
(2007)
234
COMP 158-Automated combinatorial alignment for 3-D similarity searching
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2007)
234
COMP 492-Caught in atomistic detailed action: Modeling of protein-G monomers forming oligomers
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2007)
234
ORGN 41-Quinoline oligoamide macrocycle: Selective G quadruplex binding ligand
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2007)
234
COMP 495-Tautomers, conformers, and computation of chemical similarity
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
Unexpected relaxation dynamics of a self-avoiding polymer in cylindrical confinement
(2007)
(doi: 10.48550/arxiv.0708.2099)
The derivation of hydrogen‐containing radical concentrations from satellite data sets
Quarterly Journal of the Royal Meteorological Society
(2007)
111
993
(doi: 10.1002/qj.49711146605)
Transmission of binding information across lipid bilayers
Chemistry A European Journal
(2007)
13
7215
(doi: 10.1002/chem.200601723)
Parallelizable split-operator propagator for treating Coriolis-coupled quantum dynamics
Computer Physics Communications
(2007)
177
357
(doi: 10.1016/j.cpc.2007.05.002)
Interactions of 4-Chlorophenol with TiO2 Polycrystalline Surfaces: A Study of Environmental Interfaces by NEXAFS, XPS, and UPS
Langmuir
(2007)
23
9551
(doi: 10.1021/la7012792)
NMR, PDF and RMC study of the positive electrode material Li(Ni0.5Mn0.5) O-2 synthesized by ion-exchange methods
Journal of Materials Chemistry
(2007)
17
{3167-3174}
(doi: 10.1039/b702745a)
The nucleation of inosine : the impact of solution chemistry on the appearance of polymorphic and hydrated crystal forms
Faraday Discuss
(2007)
136
179
(doi: 10.1039/b616164m)
Cocrystal architecture and properties: design and building of chiral and racemic structures by solid-solid reactions
Faraday Discussions
(2007)
136
167
(doi: 10.1039/b616399h)
Simulating ice nucleation, one molecule at a time, with the 'DFT microseope'
Faraday Discussions
(2007)
136
287
(doi: 10.1039/b616689j)
Comparative biophysical characterization of p53 with the pro-apoptotic BAK and the anti-apoptotic BCL-xL.
J Biol Chem
(2007)
282
29193
(doi: 10.1074/jbc.M705544200)
Total synthesis of (-)-reidispongiolide A, an actin-targeting marine macrolide.
Angewandte Chemie International Edition
(2007)
46
6167
(doi: 10.1002/anie.200702178)
The glass transition temperatures of amorphous trehalose-water mixtures and the mobility of water: an experimental and in silico study
Carbohydrate Research
(2007)
342
1470
(doi: 10.1016/j.carres.2007.04.011)
CAESAR: a new conformer generation algorithm based on recursive buildup and local rotational symmetry consideration.
J Chem Inf Model
(2007)
47
1923
(doi: 10.1021/ci700136x)
