Conformational preferences for hydroxyl groups in substituted tetrahydropyrans.
- Published in:
- Journal of Computational Chemistry, 1992, v. 13, n. 6, p. 772, doi. 10.1002/jcc.540130611
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- Publication type:
- Article
Works matching IS 01928651 AND DT 1992 AND VI 13 AND IP 6
Results: 12
1
2
DMC: A multifunctional hybrid dynamics/Monte Carlo simulation algorithm for the evaluation of conformational space.
- Published in:
- Journal of Computational Chemistry, 1992, v. 13, n. 6, p. 693, doi. 10.1002/jcc.540130604
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- Publication type:
- Article
3
Conformational analysis of flexible ligands in macromolecular receptor sites.
- Published in:
- Journal of Computational Chemistry, 1992, v. 13, n. 6, p. 730, doi. 10.1002/jcc.540130608
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- Publication type:
- Article
4
Electrostatic energy calculations by a Finite-difference method: Rapid calculation of charge-solvent interaction energies.
- Published in:
- Journal of Computational Chemistry, 1992, v. 13, n. 6, p. 768, doi. 10.1002/jcc.540130610
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- Publication type:
- Article
5
Theoretical calculations of β-lactam antibiotics. III. AM1, MNDO, and MINDO/3 calculations of hydrolysis of β-lactam compound (azetidin-2-one ring).
- Published in:
- Journal of Computational Chemistry, 1992, v. 13, n. 6, p. 681, doi. 10.1002/jcc.540130603
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- Publication type:
- Article
6
Theoretical study of some nitriles: Intramolecular hydrogen bonds and anomeric effect.
- Published in:
- Journal of Computational Chemistry, 1992, v. 13, n. 6, p. 722, doi. 10.1002/jcc.540130607
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- Publication type:
- Article
7
Fast geometry optimizationin self-cosistent reaction field computations on solvated molecules.
- Published in:
- Journal of Computational Chemistry, 1992, v. 13, n. 6, p. 675, doi. 10.1002/jcc.540130602
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- Publication type:
- Article
8
Effective internal rotation potential energy function of acryloyl fluoride, CH<sub>2</sub> CH CF O.
- Published in:
- Journal of Computational Chemistry, 1992, v. 13, n. 6, p. 718, doi. 10.1002/jcc.540130606
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- Publication type:
- Article
9
Masthead.
- Published in:
- Journal of Computational Chemistry, 1992, v. 13, n. 6, p. fmi, doi. 10.1002/jcc.540130601
- Publication type:
- Article
10
Computational chemical graph theory, Dennis H. Rouvray, ed., Nova Science Publisher, Inc., New York, 1990, 331 pp. ISBN 1-947143-84-5. Price: $72.00.
- Published in:
- Journal of Computational Chemistry, 1992, v. 13, n. 6, p. 792, doi. 10.1002/jcc.540130612
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- Publication type:
- Article
11
MO-Studies of enzyme reaction mechanisms. I. Model molecular orbital study of the cleavage of peptides by carboxypeptidase A.
- Published in:
- Journal of Computational Chemistry, 1992, v. 13, n. 6, p. 704, doi. 10.1002/jcc.540130605
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- Publication type:
- Article
12
Analysis of a large data base of electrostatic potential derived atomic charges.
- Published in:
- Journal of Computational Chemistry, 1992, v. 13, n. 6, p. 749, doi. 10.1002/jcc.540130609
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- Publication type:
- Article