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- Currently displaying 13121 - 13140 of 29898 publications
Annotating targets with pathways: extending approaches to mode of action analysis
Journal of cheminformatics
(2013)
5
p15
(doi: 10.1186/1758-2946-5-s1-p15)
Chemogenomics approaches to rationalising compound action of traditional Chinese and Ayurvedic medicines
Journal of Cheminformatics
(2013)
5
p44
(doi: 10.1186/1758-2946-5-s1-p44)
Relating GPCRs pharmacological space based on ligands chemical similarities
Journal of Cheminformatics
(2013)
5
p26
(doi: 10.1186/1758-2946-5-s1-p26)
Symmetrisation schemes for global optimisation of atomic clusters.
Physical Chemistry Chemical Physics
(2013)
15
3965
(doi: 10.1039/c3cp44332a)
Insights into chromatin fibre structure by in vitro and in silico single-molecule stretching experiments
Biochem Soc Trans
(2013)
41
494
(doi: 10.1042/BST20120349)
Lattice model of dynamic heterogeneity and kinetic arrest in glass-forming liquids
Soft Matter
(2013)
9
3173
(doi: 10.1039/c3sm25679k)
Synthesis of magnetic rattle-type nanostructures for use in water treatment.
ACS Appl Mater Interfaces
(2013)
5
2540
(doi: 10.1021/am303117g)
Single-crystal adsorption calorimetry and density functional theory of CO chemisorption on fcc Co{110}.
Physical Chemistry Chemical Physics
(2013)
15
4059
(doi: 10.1039/c3cp43836h)
JOYCE and ULYSSES: integrated and user-friendly tools for the parameterization of intramolecular force fields from quantum mechanical data
Physical Chemistry Chemical Physics
(2013)
15
3736
(doi: 10.1039/c3cp44179b)
Understanding the Conduction Mechanism of the Protonic Conductor CsH2PO4 by Solid-State NMR Spectroscopy
The Journal of Physical Chemistry C
(2013)
117
6504
(doi: 10.1021/jp312410t)
Hydration, acidity and metal complexing of polysulfide species: A first principles molecular dynamics study
Chemical Physics Letters
(2013)
563
9
(doi: 10.1016/j.cplett.2013.01.046)
Frequency-stepped acquisition in nuclear magnetic resonance spectroscopy under magic angle spinning.
The Journal of Chemical Physics
(2013)
138
114201
(doi: 10.1063/1.4795001)
A study of the impact of land-use change in Borneo on atmospheric composition using a global model
Atmospheric Chemistry and Physics Discussions
(2013)
13
7431
(doi: 10.5194/acpd-13-7431-2013)
Selective detection of tetrahedral units in amorphous GeTe-based phase change alloys using Ge L3-edge x-ray absorption near-edge structure spectroscopy
Applied Physics Letters
(2013)
102
111904
(doi: 10.1063/1.4794870)
Real-time single-molecule imaging reveals a direct interaction between UvrC and UvrB on DNA tightropes.
Nucleic Acids Research
(2013)
41
4901
(doi: 10.1093/nar/gkt177)
Atomic structure and hierarchical assembly of a cross-β amyloid fibril.
Proceedings of the National Academy of Sciences of the United States of America
(2013)
110
5468
(doi: 10.1073/pnas.1219476110)
Structural biology: Protein self-assembly intermediates.
Nat Chem Biol
(2013)
9
216
(doi: 10.1038/nchembio.1210)
Trifluoromethylation of 1-Aryl-3,3-diisopropyltriazenes
Advanced Synthesis & Catalysis
(2013)
355
996
(doi: 10.1002/adsc.201201040)
Tropospheric ozone changes, radiative forcing and attribution to emissions in the Atmospheric Chemistry and Climate Model Intercomparison Project (ACCMIP)
Atmospheric Chemistry and Physics
(2013)
13
3063
(doi: 10.5194/acp-13-3063-2013)
Ultratrace determination of total and available cyanides in industrial wastewaters through a rapid headspace-based sample preparation and gas chromatography with nitrogen phosphorous detection analysis
Journal of Chromatography A
(2013)
1300
209
(doi: 10.1016/j.chroma.2013.03.004)