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  • Currently displaying 14381 - 14400 of 30304 publications
Author(s)
Publication title
Journal Name
Publication year
Mean-field theory of the phase diagram of ultrasoft, oppositely charged polyions in solution
A Nikoubashman, J-P Hansen, G Kahl
J Chem Phys
(2012)
137
Full Configuration Interaction Excitations of Ethene and Butadiene: Resolution of an Ancient Question.
C Daday, S Smart, GH Booth, A Alavi, C Filippi
Journal of chemical theory and computation
(2012)
8
Using Ligand-Mapping Simulations to Design a Ligand Selectively Targeting a Cryptic Surface Pocket of Polo-Like Kinase 1
YS Tan, P Śledź, S Lang, CJ Stubbs, DR Spring, C Abell, RB Best
Angew Chem Int Ed Engl
(2012)
51
Probability based hERG blocker classifiers
Z Wang, HY Mussa, R Lowe, RC Glen, A Yan
Molecular Informatics
(2012)
31
Alternative splicing of a protein domain indispensable for function of transient receptor potential melastatin 3 (TRPM3) ion channels.
J Frühwald, J Camacho Londoño, S Dembla, S Mannebach, A Lis, A Drews, U Wissenbach, J Oberwinkler, SE Philipp
J Biol Chem
(2012)
287
Examining basilar membrane motion of an auditory model by using tone-burst otoacoustic emissions.
S Ley, A Chilian, T Harczos, A Katai, F Klefenz, P Husar
Biomed Tech (Berl)
(2012)
57 Suppl 1
Development of a phantom to modulate the maternal and fetal pulse curve for pulse oximetry measurements.
S Weyrich, S Sprenger, M Böttrich, P Schmidt, D Laqua, S Ley, P Husar
Biomedical Engineering / Biomedizinische Technik
(2012)
57
A general theory of DNA-mediated and other valence-limited colloidal interactions
P Varilly, S Angioletti-Uberti, BM Mognetti, D Frenkel
J Chem Phys
(2012)
137
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
J Am Chem Soc
(2012)
134
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
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)
14
Effect of multiple group orientations on sum frequency generation spectra
PJN Kett, MTL Casford, PB Davies
Molecular Physics
(2012)
111
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)
18
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)
20
Improved ionic conductivity in NdGdZr2O7: Influence of Sc3+ substitution
FN Sayed, BP Mandal, D Jain, CGNS Pillai, AK Tyagi
Journal of the European Ceramic Society
(2012)
32
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)
53
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
Nature Structural Molecular Biology
(2012)
19
NMR chemical shifts and protein dynamics
C Camilloni, M Vendruscolo
FEBS JOURNAL
(2012)
279
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
IEEE Photonics Conference 2012
(2012)
1
Chaperones suppress the toxicity of aberrant protein aggregates. Molecular insight into the mechanism of action
B Mannini, S Campioni, M Boninsegna, A Penco, R Cascella, M Zampagni, M Wilson, S Meehan, C Roodveldt, C Dobson, A Relini, C Cecchi, F Chiti
FEBS JOURNAL
(2012)
279