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- Currently displaying 14041 - 14060 of 29877 publications
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 LiNi0.5Mn1.5O4e
Chemistry of Materials
(2012)
24
2952
(doi: 10.1021/cm301148d)
Identifying novel adenosine receptor ligands by simultaneous proteochemometric modeling of rat and human bioactivity data.
J Med Chem
(2012)
55
7010
(doi: 10.1021/jm3003069)
The use of spectroscopic imaging and mapping techniques in the characterisation and study of DLD-1 cell spheroid tumour models
Integrative biology : quantitative biosciences from nano to macro
(2012)
4
1072
(doi: 10.1039/c2ib20121f)
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)
Comparative analysis of the influence of H-bond strength and solvent on chelate cooperativity in H-bonded supramolecular complexes
Chemical Science
(2012)
3
2462
(doi: 10.1039/c2sc20358h)
Encapsulation of a 'naked' Br- anion in a polyoxotitanate host
Chemical Science
(2012)
3
2470
(doi: 10.1039/c2sc20193c)
Pair distribution function-derived mechanism of a single-crystal to disordered to single-crystal transformation in a hemilabile metal–organic framework
Chemical Science
(2012)
3
2559
(doi: 10.1039/c2sc20261a)
Determination of structural fluctuations of proteins from structure-based calculations of residual dipolar couplings
Journal of Biomolecular NMR
(2012)
53
281
(doi: 10.1007/s10858-012-9644-3)
Hygroscopic growth and cloud activation of pollen: a laboratory and modelling study
Atmospheric Science Letters
(2012)
13
289
(doi: 10.1002/asl.397)
Learning from Nature to design new biomolecules
Current Opinion in Structural Biology
(2012)
22
395
(doi: 10.1016/j.sbi.2012.07.001)
Light on the structural communication in Ras GTPases
Journal of Biomolecular Structure and Dynamics
(2012)
31
142
(doi: 10.1080/07391102.2012.698379)
Transcription and replication of Mononegavirales: an original molecular machine
Virologie (Montrouge)
(2012)
16
225
(doi: 10.1684/vir.2012.0458)
Tropospheric bromine chemistry: implications for present and pre-industrial ozone and mercury
Atmospheric Chemistry and Physics
(2012)
12
6723
(doi: 10.5194/acp-12-6723-2012)
Copper-Catalyzed Cross-Coupling of Functionalized Alkyl Halides and Tosylates with Secondary and Tertiary Alkyl Grignard Reagents
Angew Chem Int Ed Engl
(2012)
51
9110
(doi: 10.1002/anie.201204275)
Symmetrization of the AMBER and CHARMM force fields (vol 31, pg 1402, 2010)
Journal of Computational Chemistry
(2012)
31
2209
(doi: 10.1002/jcc.23064)
Pathway-selective sensitization of Mycobacterium tuberculosis for target-based whole-cell screening.
Chemistry and Biology
(2012)
19
844