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  • Currently displaying 12721 - 12740 of 30726 publications
Author(s)
Publication title
Journal Name
Publication year
Antibodies and protein misfolding: From structural research tools to therapeutic strategies.
E De Genst, A Messer, CM Dobson
Biochim Biophys Acta
(2014)
1844
ProcessPIXEL: A program to generate energy-vector models from Gavezzotti's PIXEL calculations
AD Bond
Journal of Applied Crystallography
(2014)
47
A General Continuous Flow Method for Palladium Catalysed Carbonylation Reactions Using Single and Multiple Tube‐in‐Tube Gas‐Liquid Microreactors
U Gross, P Koos, M O'Brien, A Polyzos, SV Ley
European Journal of Organic Chemistry
(2014)
2014
An Oxalate Method for Measuring the Surface Area of Nickel Electrodes
DS Hall, C Bock, BR MacDougall
Journal of The Electrochemical Society
(2014)
161
Different Fluorophore Labeling Strategies and Designs Affect Millisecond Kinetics of DNA Hairpins
A Hartmann, G Krainer, M Schlierf
Molecules (Basel, Switzerland)
(2014)
19
Tackling sampling challenges in biomolecular simulations
A Barducci, J Pfaendtner, M Bonomi
Methods Mol Biol
(2014)
1215
Advances in molecular quantum chemistry contained in the Q-Chem 4 program package
Y Shao, Z Gan, E Epifanovsky, ATB Gilbert, M Wormit, J Kussmann, AW Lange, A Behn, J Deng, X Feng, D Ghosh, M Goldey, PR Horn, LD Jacobson, I Kaliman, RZ Khaliullin, T Kuś, A Landau, J Liu, EI Proynov, YM Rhee, RM Richard, MA Rohrdanz, RP Steele, EJ Sundstrom, HL Woodcock, PM Zimmerman, D Zuev, B Albrecht, E Alguire, B Austin, GJO Beran, YA Bernard, E Berquist, K Brandhorst, KB Bravaya, ST Brown, D Casanova, C-M Chang, Y Chen, SH Chien, KD Closser, DL Crittenden, M Diedenhofen, RA DiStasio, H Do, AD Dutoi, RG Edgar, S Fatehi, L Fusti-Molnar, A Ghysels, A Golubeva-Zadorozhnaya, J Gomes, MWD Hanson-Heine, PHP Harbach, AW Hauser, EG Hohenstein, ZC Holden, T-C Jagau, H Ji, B Kaduk, K Khistyaev, J Kim, J Kim, RA King, P Klunzinger, D Kosenkov, T Kowalczyk, CM Krauter, KU Lao, AD Laurent, KV Lawler, SV Levchenko, CY Lin, F Liu, E Livshits, RC Lochan, A Luenser, P Manohar, SF Manzer, S-P Mao, N Mardirossian, AV Marenich, SA Maurer, NJ Mayhall, E Neuscamman, CM Oana, R Olivares-Amaya, DP O’Neill, JA Parkhill, TM Perrine, R Peverati, A Prociuk, DR Rehn, E Rosta, NJ Russ, SM Sharada, S Sharma, DW Small, A Sodt, T Stein, D Stück, Y-C Su, AJW Thom, T Tsuchimochi, V Vanovschi, L Vogt, O Vydrov, T Wang, MA Watson, J Wenzel, A White, CF Williams, J Yang, S Yeganeh, SR Yost, Z-Q You, IY Zhang, X Zhang, Y Zhao, BR Brooks, GKL Chan, DM Chipman, CJ Cramer, WA Goddard, MS Gordon, WJ Hehre, A Klamt, HF Schaefer, MW Schmidt, CD Sherrill, DG Truhlar, A Warshel, X Xu, A Aspuru-Guzik, R Baer, AT Bell, NA Besley, J-D Chai, A Dreuw, BD Dunietz, TR Furlani, SR Gwaltney, C-P Hsu, Y Jung, J Kong, DS Lambrecht, W Liang, C Ochsenfeld, VA Rassolov, LV Slipchenko, JE Subotnik, T Van Voorhis, JM Herbert, AI Krylov, PMW Gill, M Head-Gordon
Molecular Physics
(2014)
113
Cys-Scanning disulfide crosslinking and bayesian modeling probe the transmembrane signaling mechanism of the histidine kinase, PhoQ
KS Molnar, M Bonomi, R Pellarin, GD Clinthorne, G Gonzalez, SD Goldberg, M Goulian, A Sali, WF Degrado
Structure
(2014)
22
Ultrafast phase-change logic device driven by melting processes.
D Loke, JM Skelton, W-J Wang, T-H Lee, R Zhao, T-C Chong, SR Elliott
Proceedings of the National Academy of Sciences of the United States of America
(2014)
111
Berichtigung: Metallfreie Anellierung von Arenen mit 2‐Aminopyridin‐Derivaten: die Methylgruppe als spurlose nichtchelatisierende dirigierende Gruppe
S Manna, K Matcha, AP Antonchick
Angewandte Chemie
(2014)
126
Metal-Free Annulation of Arenes with 2-Aminopyridine Derivatives: The Methyl Group as a Traceless Non-Chelating Directing Group (vol 53, pg 8163, 2014)
S Manna, K Matcha, AP Antonchick
Angewandte Chemie International Edition
(2014)
53
Supplementary material to "Gaseous products and Secondary Organic Aerosol formation during long term oxidation of isoprene and methacrolein"
L Brégonzio-Rozier, F Siekmann, C Giorio, E Pangui, SB Morales, B Temime-Roussel, A Gratien, V Michoud, S Ravier, A Tapparo, A Monod, J-F Doussin
(2014)
Influence of isoprene chemical mechanism on modelled changes in tropospheric ozone due to climate and land use over the 21st century
OJ Squire, AT Archibald, PT Griffiths, ME Jenkin, JA Pyle
Atmospheric Chemistry and Physics Discussions
(2014)
14
Theoretical study of DNA methylation in nucleosome
I Ivani, G Portella, M Orozco
FEBS JOURNAL
(2014)
281
Surface acidity of 2:1-type dioctahedral clay minerals from first principles molecular dynamics simulations
X Liu, J Cheng, M Sprik, X Lu, R Wang
Geochimica et Cosmochimica Acta
(2014)
140
Chiral Gold Nanowires with Boerdijk-Coxeter-Bernal Structure
Y Zhu, J He, C Shang, X Miao, J Huang, Z Liu, H Chen, Y Han
Journal of the American Chemical Society
(2014)
136
Supplementary material to "Aging of secondary organic aerosol generated from the ozonolysis of α-pinene: effects of ozone, light and temperature"
C Denjean, P Formenti, B Picquet-Varrault, M Camredon, E Pangui, P Zapf, Y Katrib, C Giorio, A Tapparo, B Temime-Roussel, A Monod, B Aumont, JF Doussin
(2014)
Concise synthesis of substituted quinolizin-4-ones by ring-closing metathesis
TA Alanine, WRJD Galloway, TM McGuire, DR Spring
European Journal of Organic Chemistry
(2014)
2014
Carbon-Embedded Carbon Nanotubes as Supports of Polymer Electrolyte Membrane Fuel Cell Catalysts
H Li, X Zhang, D He, T Peng, S Mu
Journal of nanoscience and nanotechnology
(2014)
14
Superposition enhanced nested sampling
S Martiniani, JD Stevenson, DJ Wales, D Frenkel
Physical Review X
(2014)
4