0104647 - BFU-R 20043029 RIV US eng J - Journal Article
Špačková, Naďa - Cubero, E. - Šponer, Jiří - Orozco, M.
Theoretical study of the guanine → 6-thioguanine substitution in duplexes, triplexes, and tetraplexes.
[Teoretická studie substituce guanin → 6-thioguanin v duplexech, triplexech a tetraplexech.]
Journal of the American Chemical Society. Roč. 126, č. 44 (2004), s. 14642-14650. ISSN 0002-7863. E-ISSN 1520-5126
R&D Projects: GA MŠMT LN00A016
Grant - others:European Training Mobility Program(XE) HPRI-CT-1999-00071; Ministry of Science and Technology(ES) BIO2003-06848; Wellcome Trust(GB) GR067507MF
Institutional research plan: CEZ:AV0Z5004920
Keywords : 6-thioguanine * molecular dynamics simulations * thermodynamic integration
Subject RIV: BO - Biophysics
Impact factor: 6.903, year: 2004

Molecular dynamics and thermodynamic integration calculations have been carried out on a set of G-rich single-strand, duplex, triplex, and quadruplex DNAs to study the structural and stability changes connected with the guanine to 6-thioguanine mutation.

Molekulová dynamika a termodynamická integrace byly použity pro studium změn ve struktuře a stabilitě jednořetězců, duplexů, triplexů a kvadruplexů DNA, ke kterým dochází v důsledku mutace guaninu na 6-thioguanin.
Permanent Link: http://hdl.handle.net/11104/0011913