An efficient algorithm for solving eigenvalue problems of the type HC = SCe or FC = SCe.
- Published in:
- Journal of Computational Chemistry, 1988, v. 9, n. 3, p. 257, doi. 10.1002/jcc.540090309
- By:
- Publication type:
- Article
Works matching IS 01928651 AND DT 1988 AND VI 9 AND IP 3
Results: 10
1
2
Computer generation of characteristic polynomials of edge-weighted graphs, heterographs, and directed graphs.
- Published in:
- Journal of Computational Chemistry, 1988, v. 9, n. 3, p. 204, doi. 10.1002/jcc.540090304
- By:
- Publication type:
- Article
3
Charge calculations in molecular mechanics. V. Silicon compounds and π bonding.
- Published in:
- Journal of Computational Chemistry, 1988, v. 9, n. 3, p. 244, doi. 10.1002/jcc.540090308
- By:
- Publication type:
- Article
4
YETI: An interactive molecular mechanics program for small-molecule protein complexes.
- Published in:
- Journal of Computational Chemistry, 1988, v. 9, n. 3, p. 269, doi. 10.1002/jcc.540090310
- By:
- Publication type:
- Article
5
On velocity scaling in molecular dynamics simulations.
- Published in:
- Journal of Computational Chemistry, 1988, v. 9, n. 3, p. 200, doi. 10.1002/jcc.540090303
- By:
- Publication type:
- Article
6
A novel approach to the use of graph theory in structure-activity relationship studies. Application to the qualitative evaluation of mutagenicity in a series of nonfused ring aromatic compounds.
- Published in:
- Journal of Computational Chemistry, 1988, v. 9, n. 3, p. 232, doi. 10.1002/jcc.540090307
- By:
- Publication type:
- Article
7
Effect of the substituents on the conformational behavior of five-membered rings: Application to the cis- and trans-2,5-dimethoxytetrahydrofuran.
- Published in:
- Journal of Computational Chemistry, 1988, v. 9, n. 3, p. 189, doi. 10.1002/jcc.540090302
- By:
- Publication type:
- Article
8
Application of finite-element method to the two-dimensional Schrödinger equation.
- Published in:
- Journal of Computational Chemistry, 1988, v. 9, n. 3, p. 222, doi. 10.1002/jcc.540090306
- By:
- Publication type:
- Article
9
Masthead.
- Published in:
- Journal of Computational Chemistry, 1988, v. 9, n. 3, p. fmi, doi. 10.1002/jcc.540090301
- Publication type:
- Article
10
A theoretical study of the rotational isomers of nitrosomethanol by semiempirical (AM1) and ab initio methods.
- Published in:
- Journal of Computational Chemistry, 1988, v. 9, n. 3, p. 212, doi. 10.1002/jcc.540090305
- By:
- Publication type:
- Article