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Currently displaying 13721 - 13740 of 29915 publications

Inclusion of many-body effects in the additive CHARMM protein CMAP potential results in enhanced cooperativity of α-helix and β-hairpin formation.

RB Best, J Mittal, M Feig, AD MacKerell

Biophysical journal

(2012)

103

1045

(doi: 10.1016/j.bpj.2012.07.042)

Efficient Long-Range Stereochemical Communication and Cooperative Effects in Self-Assembled Fe4L6 Cages

N Ousaka, S Grunder, AM Castilla, AC Whalley, JF Stoddart, JR Nitschke

Journal of the American Chemical Society

(2012)

134

15528

(doi: 10.1021/ja306615d)

Predicting genes involved in human cancer using network contextual information.

H Rahmani, H Blockeel, A Bender

J Integr Bioinform

(2012)

210

(doi: 10.2390/biecoll-jib-2012-210)

Synthesis of Enantiomerically Enriched 3-Amino-2-oxindoles through a Palladium-Mediated Asymmetric Intramolecular Arylation of α-Ketimino Amides

P Tolstoy, SXY Lee, C Sparr, SV Ley

Organic letters

(2012)

4810

(doi: 10.1021/ol302119j)

Effect of multiple group orientations on sum frequency generation spectra

PJN Kett, MTL Casford, PB Davies

Molecular Physics

(2012)

111

173

(doi: 10.1080/00268976.2012.711492)

Characterization of zn-containing metal-organic frameworks by solid-state 67Zn NMR spectroscopy and computational modeling

A Sutrisno, VV Terskikh, Q Shi, Z Song, J Dong, SY Ding, W Wang, BR Provost, TD Daff, TK Woo, Y Huang

Chemistry - A European Journal

(2012)

12251

(doi: 10.1002/chem.201201563)

Applications of small molecule activators and inhibitors of quorum sensing in Gram-negative bacteria

WRJD Galloway, JT Hodgkinson, S Bowden, M Welch, DR Spring

Trends in Microbiology

(2012)

449

(doi: 10.1016/j.tim.2012.06.003)

Low-cost approach for broadband enhancement of ultraviolet to visible light downconversion in fluorescent media

R Mupparapu, K Vynck, I Malfanti, S Vignolini, M Burresi, P Scudo, R Fusco, DS Wiersma

2012 IEEE PHOTONICS CONFERENCE (IPC)

(2012)

127

(doi: 10.1109/ipcon.2012.6358522)

Improved ionic conductivity in NdGdZr 2O 7: Influence of Sc 3+ substitution

FN Sayed, BP Mandal, D Jain, CGNS Pillai, AK Tyagi

Journal of the European Ceramic Society

(2012)

3221

(doi: 10.1016/j.jeurceramsoc.2012.03.038)

In support of the BMRB.

JL Markley, H Akutsu, T Asakura, M Baldus, R Boelens, A Bonvin, R Kaptein, A Bax, I Bezsonova, MR Gryk, JC Hoch, DM Korzhnev, MW Maciejewski, D Case, WJ Chazin, TA Cross, S Dames, H Kessler, O Lange, T Madl, B Reif, M Sattler, D Eliezer, A Fersht, J Forman-Kay, LE Kay, J Fraser, J Gross, T Kortemme, A Sali, T Fujiwara, K Gardner, X Luo, J Rizo-Rey, M Rosen, RR Gil, C Ho, G Rule, AM Gronenborn, R Ishima, J Klein-Seetharaman, P Tang, P van der Wel, Y Xu, S Grzesiek, S Hiller, J Seelig, ED Laue, H Mott, D Nietlispach, I Barsukov, L-Y Lian, D Middleton, T Blumenschein, G Moore, I Campbell, J Schnell, IJ Vakonakis, A Watts, MR Conte, J Mason, M Pfuhl, MR Sanderson, J Craven, M Williamson, C Dominguez, G Roberts, U Günther, M Overduin, J Werner, P Williamson, C Blindauer, M Crump, P Driscoll, T Frenkiel, A Golovanov, S Matthews, J Parkinson, D Uhrin, M Williams, D Neuhaus, H Oschkinat, A Ramos, DE Shaw, C Steinbeck, M Vendruscolo, GW Vuister, KJ Walters, H Weinstein, K Wüthrich, S Yokoyama

Nat Struct Mol Biol

(2012)

854

(doi: 10.1038/nsmb.2371)

The effect of HNE modification on the structure and function of the neuronal protein UCH-L: Links to neurodegenerative disease

SE Jackson␎, EF Werrell, ST Hsu, B Murphy, W Crone, SK Wetzel et al

Free Radical Biology and Medicine

(2012)

s241

(doi: 10.1016/j.freeradbiomed.2012.08.025)

Shouldn't enantiomeric purity be included in the 'minimum information about a bioactive entity? Response from the MIABE group.

S Orchard, B Al-Lazikani, S Bryant, D Clark, E Calder, I Dix, O Engkvist, M Forster, A Gaulton, M Gilson, R Glen, M Grigorov, K Hammond-Kosack, L Harland, A Hopkins, C Larminie, N Lynch, RK Mann, P Murray-Rust, EL Piparo, C Southan, C Steinbeck, D Wishart, H Hermjakob, J Overington, J Thornton

Nature Reviews Drug Discovery

(2012)

730

(doi: 10.1038/nrd3503-c2)

Enhanced stability and activity of temozolomide in primary glioblastoma multiforme cells with cucurbit[n]uril

EA Appel, MJ Rowland, XJ Loh, RM Heywood, C Watts, OA Scherman

Chem Commun (Camb)

(2012)

9843

(doi: 10.1039/c2cc35131e)