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Department of Chemistry

 

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  • Currently displaying 1 - 20 of 20765 publications
Trodusquemine enhances Aβ 42 aggregation but suppresses its toxicity by displacing oligomers from cell membranes
R Limbocker, S Chia, FS Ruggeri, M Perni, R Cascella, GT Heller, G Meisl, B Mannini, J Habchi, TCT Michaels, PK Challa, M Ahn, ST Casford, N Fernando, CK Xu, ND Kloss, SIA Cohen, JR Kumita, C Cecchi, M Zasloff, S Linse, TPJ Knowles, F Chiti, M Vendruscolo, CM Dobson
– Nature Communications
(2019)
10,
225
Synthesis of CC, CN coupled novel substituted dibutyl benzothiazepinone derivatives and evaluation of their thrombin inhibitory activity.
CP Baburajeev, CD Mohan, V Pandey, S Rangappa, N Shivalingegowda, L Kalash, S Devaraja, A Bender, PE Lobie, KS Rangappa, Basappa
– Bioorganic Chemistry
(2019)
87,
142
Determination of protein structural ensembles using cryo-electron microscopy
M Bonomi, M Vendruscolo
– Current Opinion in Structural Biology
(2018)
56,
37
Synthesis and encapsulation of V(IV,V) compounds in silica nanoparticles targeting development of antioxidant and antiradical nanomaterials.
E Halevas, CM Nday, D Eleftheriadou, G Jackson, V Psycharis, CP Raptopoulou, DG Reid, K Ypsilantis, G Litsardakis, A Salifoglou
– Journal of inorganic biochemistry
(2019)
194,
180
Role of carbon-rings in polycrystalline GeSb2Te4 phase-change material
G Wang, J Zhou, SR Elliott, Z Sun
– Journal of Alloys and Compounds
(2019)
782,
852
Direct Injection Liquid Chromatography High-Resolution Mass Spectrometry for Determination of Primary and Secondary Terrestrial and Marine Biomarkers in Ice Cores.
ACF King, C Giorio, E Wolff, E Thomas, M Roverso, M Schwikowski, A Tapparo, S Bogialli, M Kalberer
– Analytical Chemistry
(2019)
91,
5051
Computational advances in combating colloidal aggregation in drug discovery
D Reker, GJL Bernardes, T Rodrigues
– Nature chemistry
(2019)
Go-Kit: A Tool To Enable Energy Landscape Exploration of Proteins
S Neelamraju, DJ Wales, S Gosavi
– Journal of chemical information and modeling
(2019)
acs.jcim.9b00007
Meta-Nitration of Arenes Bearing Ortho/Para Directing Group(s) via C-H Borylation.
X Li, X Deng, AG Coyne, R Srinivasan
– Chemistry (Weinheim an der Bergstrasse, Germany)
(2019)
chem.201901633
Deprotonation, insertion and isomerisation in the post-functionalisation of tris-pyridyl aluminates
AJ Plajer, S Kopf, AL Colebatch, AD Bond, DS Wright, R García-Rodríguez
– Dalton Transactions
(2019)
The free energy landscape of the oncogene protein E7 of human papillomavirus type 16 reveals a complex interplay between ordered and disordered regions.
P Kukic, GM Lo Piccolo, MO Nogueira, DI Svergun, M Vendruscolo, IC Felli, R Pierattelli
– Scientific reports
(2019)
9,
5822
Determination of the Structural Ensemble of the Molten Globule State of a Protein by Computer Simulations.
M Shimizu, Y Kajikawa, K Kuwajima, CM Dobson, Y Okamoto
– Proteins: Structure, Function, and Bioinformatics
(2019)
prot.25688
Multitask Modeling with Confidence Using Matrix Factorization and Conformal Prediction.
U Norinder, F Svensson
– Journal of Chemical Information and Modeling
(2019)
acs.jcim.9b00027
Different soluble aggregates of Aβ42 can give rise to cellular toxicity through different mechanisms
S De, DC Wirthensohn, P Flagmeier, C Hughes, FA Aprile, FS Ruggeri, DR Whiten, D Emin, Z Xia, JA Varela, P Sormanni, F Kundel, TPJ Knowles, CM Dobson, C Bryant, M Vendruscolo, D Klenerman
– Nat Commun
(2019)
10,
1541
Synthesis, Characterization and Biological Evaluation of New Manganese Metal Carbonyl Compounds That Contain Sulfur and Selenium Ligands as a Promising New Class of CORMs
AL Amorim, MM Peterle, A Guerreiro, DF Coimbra, RS Heying, GF Caramori, AL Braga, AJ Bortoluzzi, A Neves, GJL Bernardes, RA Peralta
– Dalton transactions (Cambridge, England : 2003)
(2019)
Oligopeptide-CB[8] complexation with switchable binding pathways.
G Wu, DE Clarke, C Wu, OA Scherman
– Organic & Biomolecular Chemistry
(2019)
17,
3514
The metastability of the proteome of spinal motor neurons underlies their selective vulnerability in ALS
JJ Yerbury, L Ooi, IP Blair, P Ciryam, CM Dobson, M Vendruscolo
– Neuroscience Letters
(2019)
704,
89
Citrullination of HP1γ chromodomain affects association with chromatin
M Wiese, AJ Bannister, S Basu, W Boucher, K Wohlfahrt, MA Christophorou, ML Nielsen, D Klenerman, ED Laue, T Kouzarides
– Epigenetics & Chromatin
(2019)
12,
21
Microscopic analysis of thermo-orientation in systems of off-centre Lennard-Jones particles.
RL Jack, P Wirnsberger, A Reinhardt
– The Journal of chemical physics
(2019)
150,
134501
A simple one-step synthetic route to access a range of metal-doped polyoxovanadate clusters
H Lu, RB Jethwa, KJ Jenkinson, AEH Wheatley, H Hao, DS Wright, SD Pike
– Dalton Trans
(2019)
48,
4555