Structure-hepatoprotective activity relationship study of sesquiterpene lactones: A QSAR analysis.
- Published in:
- International Journal of Quantum Chemistry, 2009, v. 109, n. 1, p. 17, doi. 10.1002/qua.21647
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- Publication type:
- Article
Works matching IS 00207608 AND DT 2009 AND VI 109 AND IP 1
Results: 14
1
2
MaSK: A visualization tool for teaching and research in computational chemistry.
- Published in:
- International Journal of Quantum Chemistry, 2009, v. 109, n. 1, p. 8, doi. 10.1002/qua.21662
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- Publication type:
- Article
3
Computed effects of electric fields upon the C&bond;NO<sub>2</sub> and N&bond;NO<sub>2</sub> bonds of nitromethane and dimethylnitramine.
- Published in:
- International Journal of Quantum Chemistry, 2009, v. 109, n. 1, p. 3, doi. 10.1002/qua.21663
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- Article
4
Reconstruction of the (011) surface on α-quartz: A semiclassical Ab initio molecular dynamics study.
- Published in:
- International Journal of Quantum Chemistry, 2009, v. 109, n. 1, p. 50, doi. 10.1002/qua.21726
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- Publication type:
- Article
5
New approach for the correction of Ab initio molecular force fields in cartesian coordinates.
- Published in:
- International Journal of Quantum Chemistry, 2009, v. 109, n. 1, p. 28, doi. 10.1002/qua.21728
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- Publication type:
- Article
6
Prediction of excited state energies for molecular nitrogen using quantum Monte Carlo methods.
- Published in:
- International Journal of Quantum Chemistry, 2009, v. 109, n. 1, p. 43, doi. 10.1002/qua.21765
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- Publication type:
- Article
7
Calculation of the solvation state of organolithium compounds: Effects of basis sets and electron correlation methods.
- Published in:
- International Journal of Quantum Chemistry, 2009, v. 109, n. 1, p. 34, doi. 10.1002/qua.21772
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- Publication type:
- Article
8
π-π Stacking of curved carbon networks: The corannulene dimer.
- Published in:
- International Journal of Quantum Chemistry, 2009, v. 109, n. 1, p. 65, doi. 10.1002/qua.21794
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- Publication type:
- Article
9
Computational modeling of inclusion complexes of β-cyclodextrin with enantiomers of salsolinol, N-methyl-salsolinol, and 1-benzyl-tetrahydroisoquinoline.
- Published in:
- International Journal of Quantum Chemistry, 2009, v. 109, n. 1, p. 81, doi. 10.1002/qua.21852
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- Publication type:
- Article
10
Investigations of structure and dynamics of water solvation of the type I antifreeze protein.
- Published in:
- International Journal of Quantum Chemistry, 2009, v. 109, n. 1, p. 73, doi. 10.1002/qua.21857
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- Article
11
Comparison of polarization consistent and correlation consistent basis sets for noncovalent interactions.
- Published in:
- International Journal of Quantum Chemistry, 2009, v. 109, n. 1, p. 91, doi. 10.1002/qua.21876
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- Publication type:
- Article
12
Theoretical study of interactions between cysteine and perfluoropropanoic acid in gas and aqueous phase.
- Published in:
- International Journal of Quantum Chemistry, 2009, v. 109, n. 1, p. 119, doi. 10.1002/qua.21892
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- Publication type:
- Article
13
A theoretical and experimental study on manipulating the structure and properties of carbon nanotubes using substitutional dopants.
- Published in:
- International Journal of Quantum Chemistry, 2009, v. 109, n. 1, p. 97, doi. 10.1002/qua.21893
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- Article
14
Preface.
- Published in:
- International Journal of Quantum Chemistry, 2009, v. 109, n. 1, p. 1, doi. 10.1002/qua.21921
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- Publication type:
- Article