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Yusuf Hamied Department of Chemistry

 

Publications

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  • Currently displaying 5761 - 5780 of 29163 publications
Insights into mechanisms and severity of drug-induced liver injury via computational systems toxicology approach
Y Peng, Z Wu, H Yang, Y Cai, G Liu, W Li, Y Tang
– Toxicology letters
(2019)
312,
22
(doi: 10.1016/j.toxlet.2019.05.005)
Dissecting celastrol with machine learning to unveil dark pharmacology.
T Rodrigues, BP de Almeida, NL Barbosa-Morais, GJL Bernardes
– Chemical Communications
(2019)
55,
6369
(doi: 10.1039/c9cc03116b)
Intrinsically aggregation-prone proteins form amyloid-like aggregates and contribute to tissue aging in
C Huang, S Wagner-Valladolid, AD Stephens, R Jung, C Poudel, T Sinnige, MC Lechler, N Schlörit, M Lu, RF Laine, CH Michel, M Vendruscolo, CF Kaminski, GS Kaminski Schierle, DC David
– eLife
(2019)
8,
e43059
(doi: 10.7554/elife.43059)
Using Deep Learning to Annotate the Protein Universe
M Bileschi, D Belanger, D Bryant, T Sanderson, B Carter, D Sculley, M DePristo, L Colwell
(2019)
626507
(doi: 10.1101/626507)
Computational Fluorine Scanning Using Free-Energy Perturbation.
AD Wade, A Rizzi, Y Wang, DJ Huggins
– Journal of Chemical Information and Modeling
(2019)
59,
2776
(doi: 10.1021/acs.jcim.9b00228)
Radiative Effects of Residential Sector Emissions in China: Sensitivity to Uncertainty in Black Carbon Emissions
S Archer-Nicholls, D Lowe, F Lacey, R Kumar, Q Xiao, Y Liu, E Carter, J Baumgartner, C Wiedinmyer
– Journal of Geophysical Research: Atmospheres
(2019)
124,
5029
(doi: 10.1029/2018JD030120)
Computational advances in combating colloidal aggregation in drug discovery.
D Reker, GJL Bernardes, T Rodrigues
– Nature chemistry
(2019)
11,
402
(doi: 10.1038/s41557-019-0234-9)
Advancing Techniques for Investigating the Enzyme-Electrode Interface
N Kornienko, KH Ly, WE Robinson, N Heidary, JZ Zhang, E Reisner
– Accounts of Chemical Research
(2019)
52,
1439
(doi: 10.1021/acs.accounts.9b00087)
Carboxylate-Assisted Oxidative Addition to Aminoalkyl PdII Complexes: C(sp3)−H Arylation of Alkylamines by Distinct PdII/PdIV Pathway
MJ Gaunt, W Whitehurst, JH Blackwell, G Hermann
– Angewandte Chemie - International Edition
(2019)
58,
9054
(doi: 10.1002/anie.201902838)
Sustainability of using vineyard pruning residues as an energy source: Combustion performances and environmental impact
C Giorio, S Pizzini, E Marchiori, R Piazza, S Grigolato, M Zanetti, R Cavalli, M Simoncin, L Soldà, D Badocco, A Tapparo
– Fuel
(2019)
243,
371
(doi: 10.1016/j.fuel.2019.01.128)
Experimental Demonstration of Staggered CAP Modulation for Low Bandwidth Red-Emitting Polymer-LED Based Visible Light Communications
PA Haigh, A Minotto, A Burton, Z Ghassemlooy, P Murto, Z Genene, W Mammo, MR Andersson, E Wang, F Cacialli, I Darwazeh
– 2019 IEEE International Conference on Communications Workshops, ICC Workshops 2019 - Proceedings
(2019)
00,
1
(doi: 10.1109/iccw.2019.8757114)
ESPResSo++2.0: Advanced methods for multiscale molecular simulation
HV Guzman, N Tretyakov, H Kobayashi, AC Fogarty, K Kreis, J Krajniak, C Junghans, K Kremer, T Stuehn
– Computer Physics Communications
(2019)
238,
66
(doi: 10.1016/j.cpc.2018.12.017)
A light-driven burst of hydroxyl radicals dominates oxidation chemistry in newly activated cloud droplets.
SE Paulson, PJ Gallimore, XM Kuang, JR Chen, M Kalberer, DH Gonzalez
– Science Advances
(2019)
5,
eaav7689
(doi: 10.1126/sciadv.aav7689)
Enantiopure [Cs+/Xe⊂Cryptophane]⊂FeII4L4 Hierarchical Superstructures.
D Zhang, TK Ronson, JL Greenfield, T Brotin, P Berthault, E Léonce, J-L Zhu, L Xu, JR Nitschke
– Journal of the American Chemical Society
(2019)
141,
8339
(doi: 10.1021/jacs.9b02866)
Bi-Gaussian Stratified Wetting Model on Rough Surfaces.
S Hu, T Reddyhoff, D Puhan, S-C Vladescu, W Huang, X Shi, D Dini, Z Peng
– Langmuir : the ACS journal of surfaces and colloids
(2019)
35,
5967
(doi: 10.1021/acs.langmuir.9b00107)
Modeling the Structural and Thermal Properties of Loaded Metal-Organic Frameworks. An Interplay of Quantum and Anharmonic Fluctuations
V Kapil, J Wieme, S Vandenbrande, A Lamaire, V Van Speybroeck, M Ceriotti
– Journal of chemical theory and computation
(2019)
15,
3237
(doi: 10.1021/acs.jctc.8b01297)
Supplementary material to "Revised estimate of particulate emissions from Indonesian peat fires in 2015"
L Kiely, DV Spracklen, C Wiedinmyer, L Conibear, CL Reddington, S Archer-Nicholls, D Lowe, SR Arnold, C Knote, MF Khan, MT Latif, M Kuwata, SH Budisulistiorini, L Syaufina
(2019)
(doi: 10.5194/acp-2019-323-supplement)
Revised estimate of particulate emissions from Indonesian peat fires in 2015
L Kiely, DV Spracklen, C Wiedinmyer, L Conibear, CL Reddington, S Archer-Nicholls, D Lowe, SR Arnold, C Knote, MF Khan, MT Latif, M Kuwata, SH Budisulistiorini, L Syaufina
– Atmospheric Chemistry and Physics Discussions
(2019)
1
(doi: 10.5194/acp-2019-323)
Automated Acceleration of Dataflow-oriented C Applications on FPGA-based Systems
F Peverelli, M Rabozzi, S Cardamone, E Del Sozzo, AJW Thom, MD Santambrogio, L Di Tucci
– 2019 27TH IEEE ANNUAL INTERNATIONAL SYMPOSIUM ON FIELD-PROGRAMMABLE CUSTOM COMPUTING MACHINES (FCCM)
(2019)
00,
313
(doi: 10.1109/FCCM.2019.00054)
Caco-2 Monolayer Permeability and Stability of Chamaelirium luteum (False Unicorn) Open-Chain Steroidal Saponins
TP Stockdale, VL Challinor, RP Lehmann, JJ De Voss, JT Blanchfield
– ACS Omega
(2019)
4,
7658
(doi: 10.1021/acsomega.9b00496)

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