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- Currently displaying 14061 - 14080 of 30138 publications
PaDEL‐DDPredictor: Open‐source software for PD‐PK‐T prediction
Journal of computational chemistry
(2012)
34
604
(doi: 10.1002/jcc.23173)
Molecular characterization of the interaction of crotamine-derived nucleolar targeting peptides with lipid membranes
Biochim Biophys Acta
(2012)
1818
2707
(doi: 10.1016/j.bbamem.2012.06.014)
Nuclear quantum effects on the stability of cationic neon clusters
Chemical Physics Letters
(2012)
551
38
(doi: 10.1016/j.cplett.2012.09.013)
Triggered insulin release studies of triply responsive supramolecular micelles
Polymer Chemistry
(2012)
3
3180
(doi: 10.1039/c2py20380d)
Generation of 2D organic microsheets from protonated melamine derivatives: suppression of the self assembly of a particular dimension by introduction of alkyl chains
Chemical Science
(2012)
3
3227
(doi: 10.1039/c2sc20871g)
Reconstructed Ribbon Edges in Thermally Reduced Graphene Nanoribbons
The Journal of Physical Chemistry C
(2012)
116
24006
(doi: 10.1021/jp303035m)
Spiers Memorial Lecture: Effect of interaction specificity on the phase behaviour of patchy particles
Faraday Discussions
(2012)
159
9
(doi: 10.1039/c2fd20070h)
Felodipine-diaza-bicyclo-[2.2.2]octa-ne-water (1/1/1)
Acta Crystallographica Section C Crystal Structure Communications
(2012)
68
O456
(doi: 10.1107/s0108270112043405)
The influence of water and metal ions on the transport properties of trihexyl(tetradecyl)phosphonium chloride
Australian Journal of Chemistry
(2012)
65
1542
(doi: 10.1071/ch12332)
An explicitly correlated approach to basis set incompleteness in full configuration interaction quantum Monte Carlo
The Journal of Chemical Physics
(2012)
137
164112
(doi: 10.1063/1.4762445)
Modelling future changes to the stratospheric source gas injection of biogenic bromocarbons
Geophysical Research Letters
(2012)
39
2012GL053401
(doi: 10.1029/2012GL053401)
Highly Enantio‐ and Diastereoselective Generation of Two Quaternary Centers in Spirocyclopropanation of Oxindole Derivatives.
Chemistry A European Journal
(2012)
18
14929
(doi: 10.1002/chem.201203099)
Direct surface analysis of time-resolved aerosol impactor samples with ultrahigh-resolution mass spectrometry.
Anal Chem
(2012)
84
9858
(doi: 10.1021/ac3020615)
On the energetic dependence of charge separation in low-band-gap polymer/fullerene blends
J Am Chem Soc
(2012)
134
18189
(doi: 10.1021/ja308177d)
Alkyltransferase-like protein (Atl1) distinguishes alkylated guanines for DNA repair using cation-π interactions.
Proc Natl Acad Sci U S A
(2012)
109
18755
(doi: 10.1073/pnas.1209451109)
Tropical convective transport and the Walker circulation
Atmospheric Chemistry and Physics
(2012)
12
9791
(doi: 10.5194/acp-12-9791-2012)
Chemical physics of protein folding.
Proc Natl Acad Sci U S A
(2012)
109
17770
(doi: 10.1073/pnas.1215733109)
Kinetic and computational evidence for an intermediate in the hydrolysis of sulfonate esters
Organic & Biomolecular Chemistry
(2012)
10
8095
(doi: 10.1039/c2ob25699a)
Dissecting fragment-based lead discovery at the von Hippel-Lindau protein:hypoxia inducible factor 1α protein-protein interface.
Chem Biol
(2012)
19
1300