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- Currently displaying 15241 - 15260 of 30260 publications
OSCAR4: A flexible architecture for chemical textmining
J Cheminform
(2011)
3
41
(doi: 10.1186/1758-2946-3-41)
The Quixote project: Collaborative and Open Quantum Chemistry data management in the Internet age
Journal of Cheminformatics
(2011)
3
38
(doi: 10.1186/1758-2946-3-38)
Open Data, Open Source and Open Standards in chemistry: The Blue Obelisk five years on
Journal of cheminformatics
(2011)
3
37
(doi: 10.1186/1758-2946-3-37)
H2 molecules encapsulated in extended Ben cluster cages: Toward light-metal nanofoams for hydrogen storage
J Phys Chem A
(2011)
115
12105
(doi: 10.1021/jp206869g)
Defects in doped LaGaO3 anionic conductors: linking NMR spectral features, local environments, and defect thermodynamics.
J Am Chem Soc
(2011)
133
17662
(doi: 10.1021/ja2053557)
The fourth age of quantum chemistry: Molecules in motion
Phys Chem Chem Phys
(2011)
14
1085
(doi: 10.1039/c1cp21830a)
Mode-specific chemisorption of CH4 on Pt{110}-(1 × 2) explored by first-principles molecular dynamics
Journal of Physical Chemistry C
(2011)
115
21832
(doi: 10.1021/jp207746q)
Fast resonance assignment and fold determination of human superoxide dismutase by high-resolution proton-detected solid-state MAS NMR spectroscopy.
Angewandte Chemie International Edition
(2011)
50
11697
(doi: 10.1002/anie.201106340)
Structure of a Blinkin-BUBR1 complex reveals an interaction crucial for kinetochore-mitotic checkpoint regulation via an unanticipated binding Site.
Structure
(2011)
19
1691
(doi: 10.1016/j.str.2011.09.017)
Amphiphile replacement on carbon nanotube surfaces: Effect of aromatic groups on the interaction strength
Physica Status Solidi B Basic Research
(2011)
248
2532
(doi: 10.1002/pssb.201100515)
Stereoselective Synthesis of Sarmentine
Russian Journal of General Chemistry
(2011)
81
1915
(doi: 10.1134/s1070363211090337)
Inversion of the balance between hydrophobic and hydrogen bonding interactions in protein folding and aggregation.
PLoS computational biology
(2011)
7
e1002169
(doi: 10.1371/journal.pcbi.1002169)
Irreversible High-Temperature Hydrogen Interaction with the Metal Organic Framework Cu 3 (BTC) 2
The Journal of Physical Chemistry C
(2011)
115
21521
(doi: 10.1021/jp206821f)
“Cofactor”-Controlled Enantioselective Catalysis
J Am Chem Soc
(2011)
133
17176
(doi: 10.1021/ja208589c)
Aryl-Aryl Bond Formation by the Fluoride-Free Cross-Coupling of Aryldisiloxanes with Aryl Bromides
Chemistry A European Journal
(2011)
17
13230
(doi: 10.1002/chem.201102285)
Extended surfaces modulate hydrophobic interactions of neighboring solutes
Proceedings of the National Academy of Sciences of USA
(2011)
108
17678
(doi: 10.1073/pnas.1110703108)
Single crystal nuclear magnetic resonance in spinning powders.
The Journal of chemical physics
(2011)
135
144201
(doi: 10.1063/1.3640418)
pH-Driven dynamic stereoinduction: epimerization upon dimerization in rhenium(I) complexes.
Chemical Communications
(2011)
47
12765
(doi: 10.1039/c1cc14799d)