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Currently displaying 14341 - 14360 of 29867 publications

Computational prediction of metabolism: Sites, products, SAR, P450 enzyme dynamics, and mechanisms

J Kirchmair, MJ Williamson, JD Tyzack, L Tan, PJ Bond, A Bender, RC Glen

Journal of Chemical Information and Modeling

(2012)

617

(doi: 10.1021/ci200542m)

Protein misfolded oligomers: experimental approaches, mechanism of formation, and structure-toxicity relationships.

F Bemporad, F Chiti

Chem Biol

(2012)

315

(doi: 10.1016/j.chembiol.2012.02.003)

Light-Regulated Supramolecular Engineering of Polymeric Nanocapsules

DS Achilleos, TA Hatton, M Vamvakaki

J Am Chem Soc

(2012)

134

5726

(doi: 10.1021/ja212177q)

Novel pseudo-delocalized anions for lithium battery electrolytes.

E Jónsson, M Armand, P Johansson

Physical chemistry chemical physics : PCCP

(2012)

6021

(doi: 10.1039/c2cp23836e)

Polar Switching in Trialkylbenzene-1,3,5-tricarboxamides

CFC Fitié, WSC Roelofs, PCMM Magusin, M Wübbenhorst, M Kemerink, RP Sijbesma

J Phys Chem B

(2012)

116

3928

(doi: 10.1021/jp300008f)

An organocatalytic Michael-aldol cascade: formal [3+2] annulation to construct enantioenriched spirocyclic oxindole derivatives.

S-W Duan, Y Li, Y-Y Liu, Y-Q Zou, D-Q Shi, W-J Xiao

Chemical communications (Cambridge, England)

(2012)

5160

(doi: 10.1039/c2cc30931a)

An experimental screen for quinoline /fumaric acid salts and co-crystals

SL Bekö, MU Schmidt, AD Bond

Crystengcomm

(2012)

1967

(doi: 10.1039/c2ce06439a)

Macrocycle formation by proton-template-induced dimerization of complexes with (alkoxoimino)pyridine.

CM Álvarez, R García-Rodríguez, JM Martín-Alvarez, D Miguel, JA Turiel

Inorganic Chemistry

(2012)

3938

(doi: 10.1021/ic300196w)

Formation of spherical and non-spherical eutectic Gallium-Indium liquid-metal microdroplets in microfluidic channels at room temperature

T Hutter, WC Bauer, SR Elliott, WTS Huck

Advanced Functional Materials

(2012)

2624

(doi: 10.1002/adfm.201200324)

Ligand-Observed NMR in Fragment-Based Approaches

P Śledź, C Abell, A Ciulli

(2012)

264

(doi: 10.1002/9783527644506.ch15)

Forming nanoparticles of water-soluble ionic molecules and embedding them into polymer and glass substrates.

S Kiel, O Grinberg, N Perkas, J Charmet, H Kepner, A Gedanken

Beilstein J Nanotechnol

(2012)

267

(doi: 10.3762/bjnano.3.30)

Error analysis and correction for Lattice Boltzmann simulated flow conductance in capillaries of different shapes and alignments

A Sengupta, PS Hammond, D Frenkel, ES Boek

Journal of Computational Physics

(2012)

231

2634

(doi: 10.1016/j.jcp.2011.12.004)

Residue-Specific α-Helix Propensities from Molecular Simulation

RB Best, D de Sancho, J Mittal

Biophysical Journal

(2012)

102

1462

(doi: 10.1016/j.bpj.2012.02.024)

Naphthoquinone-tyrptophan reduces neurotoxic Aβ*56 levels and improves cognition in Alzheimer's disease animal model.

R Scherzer-Attali, D Farfara, I Cooper, A Levin, T Ben-Romano, D Trudler, M Vientrov, R Shaltiel-Karyo, DE Shalev, N Segev-Amzaleg, E Gazit, D Segal, D Frenkel

Neurobiology of disease

(2012)

663

(doi: 10.1016/j.nbd.2012.03.005)