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Yusuf Hamied Department of Chemistry

 

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  • Currently displaying 5641 - 5660 of 29371 publications
Predicting Macrocyclic Molecular Recognition with Machine Learning
A Tabet, T Gebhart, G Wu, C Readman, M Pierson Smela, V Rana, C Baker, H Bulstrode, P Anikeeva, D Rowitch, O Scherman
(2019)
(doi: 10.26434/chemrxiv.9540068.v1)
Modular supramolecular dimerization of optically tunable extended aryl viologens
M Olesińska, G Wu, S Gómez-Coca, D Antón-García, I Szabó, E Rosta, OA Scherman
– Chemical science
(2019)
10,
8806
(doi: 10.1039/c9sc03057c)
The Contribution of Backbone Electrostatic Repulsion to DNA Mechanical Properties is Length-Scale-Dependent
S Xiao, H Liang, DJ Wales
– The journal of physical chemistry letters
(2019)
10,
4829
(doi: 10.1021/acs.jpclett.9b01960)
Clear-sky ultraviolet radiation modelling using output from the Chemistry Climate Model Initiative
K Lamy, T Portafaix, B Josse, C Brogniez, S Godin-Beekmann, H Bencherif, L Revell, H Akiyoshi, S Bekki, MI Hegglin, P Jöckel, O Kirner, B Liley, V Marecal, O Morgenstern, A Stenke, G Zeng, N Luke Abraham, AT Archibald, N Butchart, MP Chipperfield, G Di Genova, M Deushi, SS Dhomse, RM Hu, D Kinnison, M Kotkamp, R McKenzie, M Michou, FM O'Connor, LD Oman, G Pitari, DA Plummer, JA Pyle, E Rozanov, D Saint-Martin, K Sudo, TY Tanaka, D Visioni, K Yoshida
– Atmospheric Chemistry and Physics
(2019)
19,
10087
(doi: 10.5194/acp-19-10087-2019)
Elucidating Compound Mechanism of Action and Predicting Cytotoxicity Using Machine Learning Approaches, Taking Prediction Confidence into Account
G Drakakis, I Cortés-Ciriano, B Alexander-Dann, A Bender
– Current Protocols in Chemical Biology
(2019)
11,
e73
(doi: 10.1002/cpch.73)
SLMP53-2 Restores Wild-Type-Like Function to Mutant p53 through Hsp70: Promising Activity in Hepatocellular Carcinoma.
S Gomes, B Bosco, JB Loureiro, H Ramos, L Raimundo, J Soares, N Nazareth, V Barcherini, L Domingues, C Oliveira, A Bisio, S Piazza, MR Bauer, JP Brás, MI Almeida, C Gomes, F Reis, AR Fersht, A Inga, MMM Santos, L Saraiva
– Cancers
(2019)
11,
1151
(doi: 10.3390/cancers11081151)
A Practical Guide to the Simultaneous Determination of Protein Structure and Dynamics Using Metainference
T Löhr, C Camilloni, M Bonomi, M Vendruscolo
– Methods in molecular biology (Clifton, N.J.)
(2019)
2022,
313
(doi: 10.1007/978-1-4939-9608-7_13)
Concepts and Applications of Conformal Prediction in Computational Drug Discovery
I Cortés-Ciriano, A Bender
(2019)
(link to publication)
Phase behaviour of empirical potentials of titanium dioxide
A Reinhardt
– The Journal of Chemical Physics
(2019)
151,
064505
(doi: 10.1063/1.5115161)
Water Enables Efficient CO2 Capture from Natural Gas Flue Emissions in an Oxidation-Resistant Diamine-Appended Metal-Organic Framework.
RL Siegelman, PJ Milner, AC Forse, J-H Lee, KA Colwell, JB Neaton, JA Reimer, SC Weston, JR Long
– J Am Chem Soc
(2019)
141,
13171
(doi: 10.1021/jacs.9b05567)
Particulate Photocatalysts for Light-Driven Water Splitting: Mechanisms, Challenges, and Design Strategies.
Q Wang, K Domen
– Chemical reviews
(2019)
120,
919
(doi: 10.1021/acs.chemrev.9b00201)
Ethynylbenziodoxolone Reactivity in Cysteine Bioconjugation
SR Adusumalli, GJL Bernardes
– Chem
(2019)
5,
1932
(doi: 10.1016/j.chempr.2019.07.014)
Small molecule sequestration of amyloid-β as a drug discovery strategy for Alzheimer’s disease
G Heller, F Aprile, T Michaels, R Limbocker, M Perni, FS Ruggeri, B Mannini, T Löhr, M Bonomi, C Camilloni, A De Simone, I Felli, R Pierattelli, T Knowles, C Dobson, M Vendruscolo
(2019)
729392
(doi: 10.1101/729392)
When do Anisotropic Magnetic Susceptibilities Lead to Large NMR Shifts? Exploring Particle Shape Effects in the Battery Electrode Material LiFePO
R Pigliapochi, L O'Brien, AJ Pell, MW Gaultois, Y Janssen, PG Khalifah, CP Grey
– Journal of the American Chemical Society
(2019)
141,
13089
(doi: 10.1021/jacs.9b04674)
Impact of Marginal Exciton-Charge-Transfer State Offset on Charge Generation and Recombination in Polymer:Fullerene Solar Cells
MS Vezie, M Azzouzi, AM Telford, TR Hopper, AB Sieval, JC Hummelen, K Fallon, H Bronstein, T Kirchartz, AA Bakulin, TM Clarke, J Nelson
– ACS Energy Letters
(2019)
4,
2096
(doi: 10.1021/acsenergylett.9b01368)
Catalytic Homogeneous Hydrogenation of CO to Methanol via Formamide
S Kar, A Goeppert, GKS Prakash
– J Am Chem Soc
(2019)
141,
12518
(doi: 10.1021/jacs.9b06586)
Hematite Photoanodes for Solar Water Splitting: A Detailed Spectroelectrochemical Analysis on the pH-Dependent Performance
Y Liu, F Le Formal, F Boudoire, N Guijarro
– ACS Applied Energy Materials
(2019)
2,
6825
(doi: 10.1021/acsaem.9b01261)
Scale-Bridging 3D-Analysis of Colloidal Clusters Using 360° Electron Tomography and X-Ray Nano-CT
S Englisch, J Wirth, T Przybilla, B Apeleo Zubiri, J Wang, N Vogel, E Spiecker
– Microscopy and Microanalysis
(2019)
25,
392
(doi: 10.1017/s1431927619002691)
The Molecular Composition of Humic Substances Isolated From Yedoma Permafrost and Alas Cores in the Eastern Siberian Arctic as Measured by Ultrahigh Resolution Mass Spectrometry
A Zherebker, DC Podgorski, VA Kholodov, AA Orlov, NV Yaroslavtseva, O Kharybin, A Kholodov, V Spector, RGM Spencer, E Nikolaev, IV Perminova
– Journal of Geophysical Research: Biogeosciences
(2019)
124,
2432
(doi: 10.1029/2018JG004743)
Recent Advances in Minisci-Type Reactions
RSJ Proctor, RJ Phipps
– Angewandte Chemie - International Edition
(2019)
58,
13666
(doi: 10.1002/anie.201900977)

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