Theoretical modeling and experimental studies on N-n-Decyl-2-oxo-5-nitro-1-benzylidene-methylamine.
- Published in:
- Journal of Molecular Modeling, 2009, v. 15, n. 10, p. 1281, doi. 10.1007/s00894-009-0492-3
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- Publication type:
- Article
Works matching IS 16102940 AND DT 2009 AND VI 15 AND IP 10
Results: 14
1
2
Insights into the high fidelity of a DNA polymerase I mutant.
- Published in:
- Journal of Molecular Modeling, 2009, v. 15, n. 10, p. 1271, doi. 10.1007/s00894-009-0491-4
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- Publication type:
- Article
3
AM1* parameters for vanadium and chromium.
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- Journal of Molecular Modeling, 2009, v. 15, n. 10, p. 1253, doi. 10.1007/s00894-009-0489-y
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- Article
4
Computational modeling of the adsorption and <sup>•</sup>OH initiated photochemical and photocatalytic primary oxidation of nitrobenzene.
- Published in:
- Journal of Molecular Modeling, 2009, v. 15, n. 10, p. 1237, doi. 10.1007/s00894-009-0487-0
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- Article
5
Contribution of arginine-glutamate salt bridges to helix stability.
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- Journal of Molecular Modeling, 2009, v. 15, n. 10, p. 1213, doi. 10.1007/s00894-009-0482-5
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- Publication type:
- Article
6
Towards the design of Cyclooxygenase (COX) inhibitors based on 4′,5 di-substituted biphenyl acetic acid molecules: a QSAR study with a new DFT based descriptor - nucleus independent chemical shift.
- Published in:
- Journal of Molecular Modeling, 2009, v. 15, n. 10, p. 1221, doi. 10.1007/s00894-009-0481-6
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- Publication type:
- Article
7
Homology modeling and flex-ligand docking studies on the guinea pig β<sub>2</sub> adrenoceptor: structural and experimental similarities/ differences with the human β<sub>2</sub>.
- Published in:
- Journal of Molecular Modeling, 2009, v. 15, n. 10, p. 1203, doi. 10.1007/s00894-009-0480-7
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- Article
8
Structure and localisation of drug binding sites on neurotransmitter transporters.
- Published in:
- Journal of Molecular Modeling, 2009, v. 15, n. 10, p. 1155, doi. 10.1007/s00894-009-0478-1
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- Article
9
3D pharmacophore models for thromboxane A<sub>2</sub> receptor antagonists.
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- Journal of Molecular Modeling, 2009, v. 15, n. 10, p. 1185, doi. 10.1007/s00894-009-0475-4
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- Publication type:
- Article
10
Insights into the functional role of protonation states in the HIV-1 protease-BEA369 complex: molecular dynamics simulations and free energy calculations.
- Published in:
- Journal of Molecular Modeling, 2009, v. 15, n. 10, p. 1245, doi. 10.1007/s00894-009-0452-y
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- Publication type:
- Article
11
Methyl 2-methoxy-7-(4-methylbenzoyl)-4-oxo-6-p-tolyl-4H-furo[3,2-c]pyran-3-carboxylate:A combined experimental and theoretical investigation.
- Published in:
- Journal of Molecular Modeling, 2009, v. 15, n. 10, p. 1193
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- Publication type:
- Article
12
A butterfly effect: highly insecticidal resistance caused by only a conservative residue mutated of drosophila melanogaster acetylcholinesterase.
- Published in:
- Journal of Molecular Modeling, 2009, v. 15, n. 10, p. 1229
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- Publication type:
- Article
13
Docking and molecular dynamics simulation of quinone compounds with trypanocidal activity.
- Published in:
- Journal of Molecular Modeling, 2009, v. 15, n. 10, p. 1175, doi. 10.1007/s00894-009-0468-3
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- Article
14
Theoretical study on the series of [Au<sub>3</sub>Cl<sub>3</sub>M<sub>2</sub>] complexes, with M = Li, Na, K, Rb, Cs.
- Published in:
- Journal of Molecular Modeling, 2009, v. 15, n. 10, p. 1165
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- Publication type:
- Article