Zobrazeno 1 - 10
of 135
pro vyhledávání: '"Dinucleoside Monophosphates"'
Publikováno v:
Journal of Chemical Theory and Computation. 14:1456-1470
Dinucleoside monophosphates (DNMPs) have been described using various experimental approaches as flexible molecules which generate ensembles populating at least a small set of different conformations in solution. However, due to limitations of each a
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::1283fc91b6eef6d73cfd6d7086945438
https://doi.org/10.1021/acs.jctc.7b00581
https://doi.org/10.1021/acs.jctc.7b00581
Publikováno v:
The journal of physical chemistry. B. 123(10)
Molecular dynamics (MD) simulations of 2-aminopurine (2Ap)-labeled DNA dinucleoside monophosphates (DNMPs) were performed to investigate the hypothesis that base stacking dynamics occur on timescales sufficiently rapid to influence the emission signa
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::3cb8892c337c5f2e1986dc165cd86415
https://pubmed.ncbi.nlm.nih.gov/30767498
https://pubmed.ncbi.nlm.nih.gov/30767498
Publikováno v:
Journal of Chemical Theory and Computation
The computational study of conformational transitions in nucleic acids still faces many challenges. For example, in the case of single stranded RNA tetranucleotides, agreement between simulations and experiments is not satisfactory due to inaccuracie
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::f369b6a492fa729084adb776e022004e
https://doi.org/10.1021/acs.jctc.6b00299
https://doi.org/10.1021/acs.jctc.6b00299
Autor:
Julian Garrec, Elise Dumont
Publikováno v:
Chemical Research in Toxicology
Chemical Research in Toxicology, American Chemical Society, 2014, 27 (7), pp.1282-1293. ⟨10.1021/tx4004616⟩
Chemical Research in Toxicology, 2014, 27 (7), pp.1282-1293. ⟨10.1021/tx4004616⟩
Chemical Research in Toxicology, American Chemical Society, 2014, 27 (7), pp.1282-1293. ⟨10.1021/tx4004616⟩
Chemical Research in Toxicology, 2014, 27 (7), pp.1282-1293. ⟨10.1021/tx4004616⟩
International audience; ortho-Quinone methides (ortho-QM) and para-quinone methides are generated by xenobiotic metabolism of numerous compounds including environmental toxins and therapeutic agents. These intermediates are highly electrophilic and h
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::4c3537a0b821b5b1f0d98a065ff0cc70
https://doi.org/10.1021/tx4004616
https://doi.org/10.1021/tx4004616
Akademický článek
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Autor:
Jianbo Zhao, Frank Noé, Fabian Paul, Douglas H. Turner, Giovanni Bussi, Giovanni Pinamonti, David E. Condon
Nowadays different experimental techniques, such as single molecule or relaxation experiments, can provide dynamic properties of biomolecular systems, but the amount of detail obtainable with these methods is often limited in terms of time or spatial
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::cd73ffe22d11c806f57f3c59d7cacff9
http://hdl.handle.net/20.500.11767/17423
http://hdl.handle.net/20.500.11767/17423
Publikováno v:
Recueil des Travaux Chimiques des Pays-Bas. 95:108-112
A new procedure for the synthesis of 2′-ketals of 4-thiouridine (1c), N4-methylcytidine (2a) and N4,N4-dimethylcytidine (2b), starting from the. easily accessible 3′,5′-di-O-acetyl-2′-O-(methoxytetrahydropyranyl)uridine (1b), has been devised
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::84b964ca81913daf47b6b331868d7da2
https://doi.org/10.1002/recl.19760950507
https://doi.org/10.1002/recl.19760950507
Recent computational efforts have shown that the current potential energy models used in molecular dynamics are not accurate enough to describe the conformational ensemble of RNA oligomers and suggest that molecular dynamics should be complemented wi
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::7dc4ae6a36f60acaec418c0f80685e07
http://hdl.handle.net/20.500.11767/17367
http://hdl.handle.net/20.500.11767/17367
Akademický článek
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Akademický článek
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