How flexible are DNA constituents? The quantum-mechanical study.
about
A computational study of dsDNA pairs and vibrational resonance in separating water.A novel conception for spontaneous transversions caused by homo-pyrimidine DNA mismatches: a QM/QTAIM highlight.Structure and conformational analysis of the anti-HIV reverse transcriptase inhibitor AZT using MP2 and DFT methods. Differences with the natural nucleoside thymidine. Simulation of the 1st phosphorylation step with ATP.Structural and energetic properties of the potential HIV-1 reverse transcriptase inhibitors d4A and d4G: a comprehensive theoretical investigation.Molecular structure differences between the antiviral Nucleoside Analogue 5-iodo-2'-deoxyuridine and the natural nucleoside 2'-deoxythymidine using MP2 and DFT methods: conformational analysis, crystal simulations, DNA pairs and possible behaviour.Atomistic understanding of the C·T mismatched DNA base pair tautomerization via the DPT: QM and QTAIM computational approaches.DPT tautomerization of the long A∙A Watson-Crick base pair formed by the amino and imino tautomers of adenine: combined QM and QTAIM investigation.Efficient estimation of MMGBSA-based BEs for DNA and aromatic furan amidino derivatives.DNA base stacking: the stacked uracil/uracil and thymine/thymine minima.Physico-chemical profiles of the wobble ↔ Watson-Crick G*·2AP(w) ↔ G·2AP(WC) and A·2AP(w) ↔ A*·2AP(WC) tautomerisations: a QM/QTAIM comprehensive survey.The significant role of the intermolecular CH⋯O/N hydrogen bonds in governing the biologically important pairs of the DNA and RNA modified bases: a comprehensive theoretical investigation.The nature of the transition mismatches with Watson-Crick architecture: the G*·T or G·T* DNA base mispair or both? A QM/QTAIM perspective for the biological problem.Surprising Conformers of the Biologically Important A·T DNA Base Pairs: QM/QTAIM Proofs.Nucleotides containing variously modified sugars: energetics, structure, and mechanical properties.Atomistic nature of the DPT tautomerisation of the biologically important C·C* DNA base mispair containing amino and imino tautomers of cytosine: a QM and QTAIM approach.Novel pathway for mutagenic tautomerization of classical А∙Т DNA base pairs via sequential proton transfer through quasi-orthogonal transition states: A QM/QTAIM investigation.Complete conformational space of the potential HIV-1 reverse transcriptase inhibitors d4U and d4C. A quantum chemical studyCan DNA-binding proteins of replisome tautomerize nucleotide bases? Ab initio model study
P2860
Q36064693-4BBD86B8-892B-4029-A6EB-94EF31419EF1Q40685131-8A295EF7-601C-446F-8A2B-2CDAA854A314Q42183553-A78B51B3-E109-44E2-ADE1-BDB201380855Q42276579-76D8EBB9-5DBA-4434-AB56-B44438881F37Q44554964-CD9716EE-8D21-4763-83AC-351996F0625CQ45804024-219A275B-A09C-45F6-8B87-E3D62E52C66FQ45897541-7A60DFBB-683A-48BF-8ACE-65D271D817B1Q47285132-CCD38FD4-5590-490A-9250-FD60066C735EQ49126127-F74F2FDB-C953-4294-90E7-F00E39DC6D82Q49948938-D13CF18A-D06C-47CC-9D37-B9DFC1B13B10Q51019686-B4FA0400-2514-4A0A-9354-E2CDE0C044CAQ51084530-2953916D-ADD4-4241-98B7-7973FDE3579CQ52656982-9861B852-5840-43DC-91AC-7220A5DB3CFAQ53805094-AF3B33B5-1059-4DB8-AC35-34047CC6BB4AQ54705027-822920BA-99E8-46BF-BAD0-73650D14CD21Q55513307-3C0AF76A-21B3-4D42-90C5-A6A787578772Q56170868-1CF96A48-0DD8-4C74-92D5-EB46D7177C36Q57128326-57D13D1E-D96D-4B5B-9A3C-64E0AEB6C9C7
P2860
How flexible are DNA constituents? The quantum-mechanical study.
description
2011 nî lūn-bûn
@nan
2011年の論文
@ja
2011年学术文章
@wuu
2011年学术文章
@zh
2011年学术文章
@zh-cn
2011年学术文章
@zh-hans
2011年学术文章
@zh-my
2011年学术文章
@zh-sg
2011年學術文章
@yue
2011年學術文章
@zh-hant
name
How flexible are DNA constituents? The quantum-mechanical study.
@en
How flexible are DNA constituents? The quantum-mechanical study.
@nl
type
label
How flexible are DNA constituents? The quantum-mechanical study.
@en
How flexible are DNA constituents? The quantum-mechanical study.
@nl
prefLabel
How flexible are DNA constituents? The quantum-mechanical study.
@en
How flexible are DNA constituents? The quantum-mechanical study.
@nl
P2093
P2860
P1476
How flexible are DNA constituents? The quantum-mechanical study.
@en
P2093
D M Hovorun
L A Bulavin
T Yu Nikolaienko
P2860
P304
P356
10.1080/07391102.2011.10507406
P577
2011-12-01T00:00:00Z