Dynamic design: manipulation of millisecond timescale motions on the energy landscape of cyclophilin A

Autor: Harris Ioannidis, Alessio De Simone, Arun A. Gupta, Jordi Juárez-Jiménez, Andrew Baldwin, Malcolm D. Walkinshaw, Gogulan Karunanithy, Julien Michel, Antonia S. J. S. Mey, Alison N. Hulme, Charis Georgiou, Paul N. Barlow

Publikováno v: Chemical Science
Juárez-jiménez, J, Gupta, A A, Karunanithy, G, Mey, A S J S, Georgiou, C, Ioannidis, H, De Simone, A, Barlow, P N, Hulme, A N, Walkinshaw, M D, Baldwin, A J & Michel, J 2020, ' Dynamic design : Manipulation of millisecond timescale motions on the energy landscape of cyclophilin A ', Chemical Science, vol. 11, no. 10, pp. 2670-2680 . https://doi.org/10.1039/C9SC04696H
Dipòsit Digital de la UB
Universidad de Barcelona

Proteins need to interconvert between many conformations in order to function, many of which are formed transiently, and sparsely populated. Particularly when the lifetimes of these states approach the millisecond timescale, identifying the relevant

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::6d0ba71167b38389d43b04acead7d98d
http://hdl.handle.net/2445/179325

Historical mystery solved: a multi-analytical approach to the identification of a key marker for the historical use of brazilwood (Caesalpinia spp.) in paintings and textiles

Autor: Julija Romanuka, David A. Peggie, Alessio De Simone, Jennifer Poulin, Wim Genuit, David F. Wills, Jo Kirby, Alison N. Hulme

Publikováno v: Peggie, D, Kirby, J, Poulin, J, Genuit, W, Romanuka, J, Wills, D F, De Simone, A & Hulme, A N 2018, ' Historical mystery solved: A multi-analytical approach to the identification of a key marker for the historical use of brazilwood (Caesalpinia spp.) in paintings and textiles ', Analytical methods . https://doi.org/10.1039/C7AY02626A

Dyes derived from brazilwood (Caesalpinia spp.) are known to have been used in a diverse range of objects, from Medieval European textiles to North American First Nations objects, while pigments made from brazilwood feature in the palette of a number

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::f6936272f38cb6ab96e2dcaf644f67cb
https://doi.org/10.1039/c7ay02626a

Front Cover: Multitarget Compounds for Bipolar Disorder: From Rational Design to Preliminary Pharmacokinetic Evaluation (ChemMedChem 11/2020)

Autor: Federica Belluti, Andrea Armirotti, Rita Maria Concetta Di Martino, Giuliana Ottonello, Sine Mandrup Bertozzi, Giovanni Bottegoni, Ilaria Penna, Tiziano Bandiera, Francesca Seghetti, Andrea Cavalli, Debora Russo, Alessio De Simone

Publikováno v: ChemMedChem. 15:906-906

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_________::c968a4a1f9883a35161459e7af4de8fb
https://doi.org/10.1002/cmdc.202000315

N-Hydroxyindole-based inhibitors of lactate dehydrogenase against cancer cell proliferation

Autor: Sarabindu Roy, Alessio De Simone, Antonio Lucacchini, Gino Giannaccini, Elisa Giovannetti, Tiziano Tuccinardi, Laura Betti, Godefridus J. Peters, Adriano Martinelli, Carlotta Granchi, Irene Salvetti, Rocco Sciarrillo, Filippo Minutolo, Marco Macchia, Mario Lanza

Publikováno v: Granchi, C, Roy, S, De Simone, A, Salvetti, I, Tuccinardi, T, Martinelli, A, Macchia, M, Lanza, M, Betti, L, Giannaccini, G, Lucacchini, A, Giovannetti, E, Sciarrillo, R, Peters, G J & Minutolo, F 2011, ' N-Hydroxyindole-based inhibitors of lactate dehydrogenase against cancer cell proliferation ', European Journal of Medicinal Chemistry, vol. 46, no. 11, pp. 5398-5407 . https://doi.org/10.1016/j.ejmech.2011.08.046
European Journal of Medicinal Chemistry, 46(11), 5398-5407. Elsevier Masson SAS

Current cancer research is being increasingly focused on the study of distinctive characters of tumour metabolism, resulting in a switch from oxidative phosphorylation to glycolysis (Warburg effect). Isoform 5 of human lactate dehydrogenase (hLDH5),

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::1c2b5eb6a08bbeef78124ade159c9e03
https://doi.org/10.1016/j.ejmech.2011.08.046