Yusuf Hamied Department of Chemistry

Publications

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  • Currently displaying 5241 - 5260 of 29886 publications
Author(s)
Publication title
Journal Name
Publication year
Editorial overview: Toward smart medicines
GJL Bernardes, R Rodriguez
Curr Opin Chem Biol
(2020)
56
(doi: 10.1016/j.cbpa.2020.04.011)
NWChem: Past, present, and future.
E Aprà, EJ Bylaska, WA de Jong, N Govind, K Kowalski, TP Straatsma, M Valiev, HJJ van Dam, Y Alexeev, J Anchell, V Anisimov, FW Aquino, R Atta-Fynn, J Autschbach, NP Bauman, JC Becca, DE Bernholdt, K Bhaskaran-Nair, S Bogatko, P Borowski, J Boschen, J Brabec, A Bruner, E Cauët, Y Chen, GN Chuev, CJ Cramer, J Daily, MJO Deegan, TH Dunning, M Dupuis, KG Dyall, GI Fann, SA Fischer, A Fonari, H Früchtl, L Gagliardi, J Garza, N Gawande, S Ghosh, K Glaesemann, AW Götz, J Hammond, V Helms, ED Hermes, K Hirao, S Hirata, M Jacquelin, L Jensen, BG Johnson, H Jónsson, RA Kendall, M Klemm, R Kobayashi, V Konkov, S Krishnamoorthy, M Krishnan, Z Lin, RD Lins, RJ Littlefield, AJ Logsdail, K Lopata, W Ma, AV Marenich, J Martin Del Campo, D Mejia-Rodriguez, JE Moore, JM Mullin, T Nakajima, DR Nascimento, JA Nichols, PJ Nichols, J Nieplocha, A Otero-de-la-Roza, B Palmer, A Panyala, T Pirojsirikul, B Peng, R Peverati, J Pittner, L Pollack, RM Richard, P Sadayappan, GC Schatz, WA Shelton, DW Silverstein, DMA Smith, TA Soares, D Song, M Swart, HL Taylor, GS Thomas, V Tipparaju, DG Truhlar, K Tsemekhman, T Van Voorhis, Á Vázquez-Mayagoitia, P Verma, O Villa, A Vishnu, KD Vogiatzis, D Wang, JH Weare, MJ Williamson, TL Windus, K Woliński, AT Wong, Q Wu, C Yang, Q Yu, M Zacharias, Z Zhang, Y Zhao, RJ Harrison
J Chem Phys
(2020)
152
(doi: 10.1063/5.0004997)
The antidiabetic drug lobeglitazone has the potential to inhibit PTP1B activity
RF Rocha, T Rodrigues, ACO Menegatti, GJL Bernardes, H Terenzi
Bioorganic chemistry
(2020)
100
(doi: 10.1016/j.bioorg.2020.103927)
Disorder by design: A data-driven approach to amorphous semiconductors without total-energy functionals
DK Limbu, SR Elliott, R Atta-Fynn, P Biswas
Scientific reports
(2020)
10
(doi: 10.1038/s41598-020-64327-3)
Reaching Full Correlation through Nonorthogonal Configuration Interaction: A Second-Order Perturbative Approach
HGA Burton, AJW Thom
(2020)
(doi: 10.48550/arxiv.2005.03962)
Band Positions of Anatase (001) and (101) Surfaces in Contact with Water from Density Functional Theory
J Geiger, M Sprik, M May
(2020)
(doi: 10.26434/chemrxiv.12263837)
Reactive Momentum Transfer Contributes to the Self-Propulsion of Janus Particles.
S Eloul, WCK Poon, O Farago, D Frenkel
Physical review letters
(2020)
124
(doi: 10.1103/physrevlett.124.188001)
A kinetic ensemble of the Alzheimer’s Aβ peptide
T Löhr, K Kohlhoff, GT Heller, C Camilloni, M Vendruscolo
(2020)
(doi: 10.1101/2020.05.07.082818)
Band Positions of Anatase (001) and (101) Surfaces in Contact with Water from Density Functional Theory
J Geiger, M Sprik, M May
(2020)
(doi: 10.26434/chemrxiv.12263837.v1)
Reentrant Liquid Condensate Phase of Proteins is Stabilized by Hydrophobic and Non-Ionic interactions
G Krainer, TJ Welsh, JA Joseph, JR Espinosa, S Wittmann, E de Csilléry, A Sridhar, Z Toprakcioglu, G Gudiškytė, MA Czekalska, WE Arter, P St George-Hyslop, AA Hyman, R Collepardo-Guevara, S Alberti, TPJ Knowles
BIOPHYSICAL JOURNAL
(2020)
120
(doi: 10.1101/2020.05.04.076299)
Guest Binding Drives Host Redistribution in Libraries of CoII4L4 Cages
M Kieffer, RA Bilbeisi, JD Thoburn, JK Clegg, JR Nitschke
Angewandte Chemie
(2020)
132
(doi: 10.1002/ANGE.202004627)
Understanding Surface Recombination Processes Using Intensity‐Modulated Photovoltage Spectroscopy on Hematite Photoanodes for Solar Water Splitting
Y Liu, N Guijarro, K Sivula
Helvetica Chimica Acta
(2020)
103
(doi: 10.1002/hlca.202000064)
Assessing the Onset of Calcium Phosphate Nucleation by Hyperpolarized Real-Time NMR.
EMM Weber, T Kress, D Abergel, S Sewsurn, T Azaïs, D Kurzbach
Anal Chem
(2020)
92
(doi: 10.1021/acs.analchem.0c00516)
Strong Circular Dichroism in Single Gyroid Optical Metamaterials
C Kilchoer, N Abdollahi, JA Dolan, D Abdelrahman, M Saba, U Wiesner, U Steiner, I Gunkel, BD Wilts
Advanced Optical Materials
(2020)
8
(doi: 10.1002/adom.201902131)
Evaluating the simulated radiative forcings, aerosol properties and stratospheric warmings from the 1963 Agung, 1982 El Chichón and 1991 Mt Pinatubo volcanic aerosol clouds
SS Dhomse, GW Mann, JCA Marrero, SE Shallcross, MP Chipperfield, KS Carslaw, L Marshall, NL Abraham, CE Johnson
(2020)
2020
(doi: 10.5194/acp-2020-344)
Selective NMR observation of the SEI–metal interface by dynamic nuclear polarisation from lithium metal
MA Hope, BLD Rinkel, AB Gunnarsdóttir, K Märker, S Menkin, S Paul, IV Sergeyev, CP Grey
Nature Communications
(2020)
11
(doi: 10.1038/s41467-020-16114-x)
Design, Synthesis, and Characterization of the Macrocyclic Tetrapeptide cyclo[Pro-Sar-Phe-d-Phe]: A Mixed Opioid Receptor Agonist-Antagonist Following Oral Administration.
MJ Ferracane, AC Brice-Tutt, JS Coleman, GG Simpson, LL Wilson, SO Eans, HM Stacy, TF Murray, JP McLaughlin, JV Aldrich
ACS Chemical Neuroscience
(2020)
11
(doi: 10.1021/acschemneuro.0c00086)
A synthetic mechanogenetic gene circuit for autonomous drug delivery in engineered tissues
Z-H Goh
(2020)
(doi: 10.1242/prelights.20154)
Seeking Heteroatom-Rich Compounds: Synthetic and Mechanistic Studies into Iron Catalyzed Dehydrocoupling of Silanes
D Gasperini, AK King, NT Coles, MF Mahon, RL Webster
ACS Catalysis
(2020)
10
(doi: 10.1021/acscatal.0c01440)
Using Predicted Bioactivity Profiles to Improve Predictive Modeling
U Norinder, O Spjuth, F Svensson
Journal of Chemical Information and Modeling
(2020)
60
(doi: 10.1021/acs.jcim.0c00250)
Yusuf Hamied Department of Chemistry
Lensfield Road
Cambridge
CB2 1EW
T: +44 (0) 1223 336300
enquiries@ch.cam.ac.uk
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