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- Currently displaying 14021 - 14040 of 29867 publications
The semantics of Chemical Markup Language (CML) for computational chemistry : CompChem.
Journal of cheminformatics
(2012)
4
15
(doi: 10.1186/1758-2946-4-15)
Four-Site Cooperative Spin Crossover in Polymorphs of a Mononuclear Fe(II) Complex
Acta Crystallographica Section A: Foundations and advances
(2012)
68
S78
(doi: 10.1107/S0108767312098492)
Solution and Solid-State Supramolecular Chemistry of Naphthalenediimides
Acta Crystallographica Section A: Foundations and advances
(2012)
68
s116
(doi: 10.1107/s0108767312097759)
Halide Anions as Shape-Directing Agents for Obtaining High-Quality Anisotropic Gold Nanostructures
Chemistry of Materials
(2012)
25
1392
(doi: 10.1021/cm3020397)
Optimization of the additive CHARMM all-atom protein force field targeting improved sampling of the backbone φ, ψ and side-chain χ(1) and χ(2) dihedral angles.
Journal of Chemical Theory and Computation
(2012)
8
3257
(doi: 10.1021/ct300400x)
First-order rate-determining aggregation mechanism of p53 and its implications.
Proc Natl Acad Sci U S A
(2012)
109
13590
(doi: 10.1073/pnas.1211557109)
Kinetic mechanism of p53 oncogenic mutant aggregation and its inhibition.
Proc Natl Acad Sci U S A
(2012)
109
13584
(doi: 10.1073/pnas.1211550109)
Continuous multiple liquid-liquid separation: Diazotization of amino acids in flow
Org Lett
(2012)
14
4246
(doi: 10.1021/ol301930h)
Fabrication of microgel particles with complex shape via selective polymerization of aqueous two-phase systems.
Small
(2012)
8
2356
(doi: 10.1002/smll.201102715)
ADP ribosylation adapts an ER chaperone response to short-term fluctuations in unfolded protein load.
Journal of Cell Biology
(2012)
198
371
(doi: 10.1083/jcb.201202005)
Expanding the genetic code of Drosophila melanogaster
Nature Chemical Biology
(2012)
8
748
(doi: 10.1038/nchembio.1043)
Anion-induced reconstitution of a self-assembling system to express a chloride-binding Co10L15 pentagonal prism
Nature chemistry
(2012)
4
751
(doi: 10.1038/NCHEM.1407)
On the Increase in Boundary Friction with Sliding Speed
Tribology Letters
(2012)
48
237
(doi: 10.1007/s11249-012-0019-4)
Quantification of chemical and physical processes influencing ozone during long-range transport using a trajectory ensemble
Atmospheric Chemistry and Physics
(2012)
12
7015
(doi: 10.5194/acp-12-7015-2012)
Theoretical Study of the Importance of the Spectator Groups on the Hydrolysis of Phosphate Triesters
The Journal of Organic Chemistry
(2012)
77
7061
(doi: 10.1021/jo301380v)
Composition-Structure Relationships in the Li-Ion Battery Electrode Material LiNi0.5Mn1.5O4
Chemistry of materials : a publication of the American Chemical Society
(2012)
24
2952
(doi: 10.1021/cm301148d)
Identifying novel adenosine receptor ligands by simultaneous proteochemometric modeling of rat and human bioactivity data.
Journal of Medicinal Chemistry
(2012)
55
7010
(doi: 10.1021/jm3003069)
A prototype continuous-flow liquid-liquid extraction system using open-source technology
Organic & Biomolecular Chemistry
(2012)
10
7031
(doi: 10.1039/c2ob25912e)
Noncovalent organocatalytic synthesis of enantioenriched terminal aziridines with a quaternary stereogenic center.
Organic Letters
(2012)
14
4078
(doi: 10.1021/ol3017066)
