Yusuf Hamied Department of Chemistry

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  • Currently displaying 11441 - 11460 of 29246 publications
Author(s)
Publication title
Journal Name
Publication year
processPIXEL: a program to generate energy-vector models from Gavezzotti's PIXEL calculations
AD Bond
Journal of Applied Crystallography
(2014)
47
(doi: 10.1107/s1600576714016446)
An oxalate method for measuring the surface area of nickel electrodes
DS Hall, C Bock, BR MacDougall
Journal of the Electrochemical Society
(2014)
161
(doi: 10.1149/2.0711412jes)
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
(doi: 10.1080/00268976.2014.952696)
Different fluorophore labeling strategies and designs affect millisecond kinetics of DNA hairpins.
A Hartmann, G Krainer, M Schlierf
Molecules
(2014)
19
(doi: 10.3390/molecules190913735)
Tackling sampling challenges in biomolecular simulations
A Barducci, J Pfaendtner, M Bonomi
Methods in Molecular Biology
(2014)
1215
(doi: 10.1007/978-1-4939-1465-4_8)
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
(doi: 10.1016/j.str.2014.04.019)
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
(doi: 10.1002/anie.201407501)
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
(doi: 10.1002/ange.201407501)
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)
(doi: 10.5194/acpd-14-22507-2014-supplement)
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
(2014)
111
(doi: 10.1073/pnas.1407633111)
Chiral Gold Nanowires with Boerdijk-Coxeter-Bernal Structure
Y Zhu, J He, C Shang, X Miao, J Huang, Z Liu, H Chen, Y Han
J Am Chem Soc
(2014)
136
(doi: 10.1021/ja506554j)
Towards an MIE atlas - Definition and role
T Allen, J Goodman, S Gutsell, P Russell
Toxicology Letters
(2014)
229
(doi: 10.1016/j.toxlet.2014.06.217)
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
(doi: 10.1002/ejoc.201402648)
Toxicity prediction using heterogeneous chemical and biological data sources
A Bender
Toxicology Letters
(2014)
229
(doi: 10.1016/j.toxlet.2014.06.040)
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
(doi: 10.1016/j.gca.2014.05.044)
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)
(doi: 10.5194/acpd-14-22437-2014-supplement)
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
(doi: 10.1166/jnn.2014.8926)
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
(doi: 10.5194/acpd-14-22385-2014)
Superposition enhanced nested sampling
S Martiniani, JD Stevenson, DJ Wales, D Frenkel
Physical Review X
(2014)
4
(doi: 10.1103/physrevx.4.031034)
Facile Method for Preparing Surface-Mounted Cucurbit[8]uril-Based Rotaxanes
C Hu, Y Lan, F Tian, KR West, OA Scherman
Langmuir : the ACS journal of surfaces and colloids
(2014)
30
(doi: 10.1021/la5026125)
Yusuf Hamied Department of Chemistry
Lensfield Road
Cambridge
CB2 1EW
T: +44 (0) 1223 336300
enquiries@ch.cam.ac.uk
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