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COMPUTATIONAL DESCRIPTION OF PEPTIDE ARCHITECTURES BASED ON HYDROGEN BONDS
被引:0
作者
:
Silaghi-Dumitrescu, Radu
论文数:
0
引用数:
0
h-index:
0
机构:
Univ Babes Bolyai, Fac Chim & Ingn Chim, RO-400084 Cluj Napoca, Romania
Univ Babes Bolyai, Fac Chim & Ingn Chim, RO-400084 Cluj Napoca, Romania
Silaghi-Dumitrescu, Radu
[
1
]
机构
:
[1]
Univ Babes Bolyai, Fac Chim & Ingn Chim, RO-400084 Cluj Napoca, Romania
来源
:
STUDIA UNIVERSITATIS BABES-BOLYAI CHEMIA
|
2010年
/ 55卷
/ 01期
关键词
:
peptide;
density functional;
semiempirical;
Hartree-Fock;
hydrogen bond;
IRON-SULFUR CLUSTERS;
TRANSITION-METAL SYSTEMS;
NMR-SPECTROSCOPY;
REDOX PROPERTIES;
PROTEIN;
RUBREDOXIN;
D O I
:
暂无
中图分类号
:
O6 [化学];
学科分类号
:
0703 ;
摘要
:
The geometrical structures of systems whose architectures rely entirely on hydrogen bonds, such as a-helical polypeptides, are not always properly described with current computational methods.
引用
收藏
页码:31 / 36
页数:6
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Mcnamara, Jonathan P.
;
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论文数:
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Univ Manchester, Sch Chem, Manchester M13 9PL, Lancs, England
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[14]
Development of parameter sets for semi-empirical MO calculations of transition metal systems: Iron parameters for iron-sulfur proteins
[J].
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0
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h-index:
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机构:
Univ Manchester, Sch Chem, Manchester M13 9PL, Lancs, England
Univ Manchester, Sch Chem, Manchester M13 9PL, Lancs, England
McNamara, JP
;
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Sundararajan, M
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Hillier, IH
论文数:
0
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0
h-index:
0
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Univ Manchester, Sch Chem, Manchester M13 9PL, Lancs, England
Univ Manchester, Sch Chem, Manchester M13 9PL, Lancs, England
Hillier, IH
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JOURNAL OF MOLECULAR GRAPHICS & MODELLING,
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论文数:
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h-index:
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WASHINGTON UNIV,SCH MED,DEPT BIOCHEM & MOLEC BIOPHYS,ST LOUIS,MO 63110
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h-index:
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JOURNAL OF MOLECULAR BIOLOGY,
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(02)
:228
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[J].
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论文数:
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引用数:
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h-index:
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Scripps Res Inst, Dept Mol Biol, La Jolla, CA 92037 USA
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[J].
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;
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论文数:
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引用数:
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机构:
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Lund Univ, Ctr Chem, Dept Theoret Chem, S-22100 Lund, Sweden
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引用数:
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h-index:
0
机构:
Lund Univ, Ctr Chem, Dept Theoret Chem, S-22100 Lund, Sweden
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Silagui-Dumitrescu R, 2004, REV CHIM-BUCHAREST, V55, P304
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[J].
Sulpizi, Marialore
论文数:
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引用数:
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h-index:
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Univ Cambridge, Dept Chem, Cambridge CB2 1EW, England
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论文数:
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引用数:
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Univ Cambridge, Dept Chem, Cambridge CB2 1EW, England
Raugei, Simone
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论文数:
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VandeVondele, Joost
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Carloni, Paolo
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引用数:
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←
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2
3
→