Works matching IS 01928651 AND DT 1995 AND VI 16 AND IP 4

Results: 15

Intervals and the deduction of drug binding site models.

Published in:

Journal of Computational Chemistry, 1995, v. 16, n. 4, p. 486, doi. 10.1002/jcc.540160412

By:

Crippen, Gordon M.

Publication type:

Article

The extended law of corresponding states and the intermolecular potentials for HeHe and NeNe.

Published in:

Journal of Computational Chemistry, 1995, v. 16, n. 4, p. 441, doi. 10.1002/jcc.540160406

By:

Behnejad, H.;
Maghari, A.;
Najafi, M.

Publication type:

Article

Masthead.

Published in:: Journal of Computational Chemistry, 1995, v. 16, n. 4, p. fmi, doi. 10.1002/jcc.540160401
Publication type:: Article

Improved methods for semiempirical solvation models.

Published in:

Journal of Computational Chemistry, 1995, v. 16, n. 4, p. 422, doi. 10.1002/jcc.540160405

By:

Liotard, Daniel A.;
Hawkins, Gregory D.;
Lynch, Gillian C.;
Cramer, Christopher J.;
Truhlar, Donald G.

Publication type:

Article

A molecular mechanics/grid method for evaluation of ligand-receptor interactions.

Published in:

Journal of Computational Chemistry, 1995, v. 16, n. 4, p. 454, doi. 10.1002/jcc.540160409

By:

Luty, Brock A.;
Wasserman, Zelda R.;
Stouten, Pieter F. W.;
Hodge, C. Nicholas;
Zacharias, Martin;
McCammon, J. Andrew

Publication type:

Article

Determination of C-terminal structure of human CHaras oncogenic protein.

Published in:

Journal of Computational Chemistry, 1995, v. 16, n. 4, p. 478, doi. 10.1002/jcc.540160411

By:

Yoon, Jeong Hyeok;
Shin, Jae Kwang;
Jhon, Mu Shik

Publication type:

Article

Fast, fuzzy c-means clustering of data sets with many features.

Published in:

Journal of Computational Chemistry, 1995, v. 16, n. 4, p. 414, doi. 10.1002/jcc.540160404

By:

Alsberg, Bjørn K.

Publication type:

Article

Analytical approach to very large benzenoid polymers.

Published in:

Journal of Computational Chemistry, 1995, v. 16, n. 4, p. 517, doi. 10.1002/jcc.540160415

By:

Živković, T.;
Randić, M.;
Klein, D. J.;
Zhu, H.-Y.;
Trinajstić, N.

Publication type:

Article

Prediction of LUMO energy and rate constant by comparative molecular field analysis (CoMFA).

Published in:

Journal of Computational Chemistry, 1995, v. 16, n. 4, p. 449, doi. 10.1002/jcc.540160408

By:

Yoo, Sung-Eun;
Cha, Ok Ja

Publication type:

Article

Theoretical investigation of the relative stabilities of XSS X and X<sub>2</sub>SS isomers ( X = F, Cl, H, and CH<sub>3</sub>).

Published in:

Journal of Computational Chemistry, 1995, v. 16, n. 4, p. 465, doi. 10.1002/jcc.540160410

By:

Bickelhaupt, F. Matthias;
Solà, Miquel;
von Ragué Schleyer, Paul

Publication type:

Article

SINDO1 study of the photoreaction of tetramethylene sulfone.

Published in:

Journal of Computational Chemistry, 1995, v. 16, n. 4, p. 405, doi. 10.1002/jcc.540160403

By:

Gerwens, Heiko;
Jug, Karl

Publication type:

Article

Calculating the electric potential of macromolecules: A simple method for molecular surface triangulation.

Published in:

Journal of Computational Chemistry, 1995, v. 16, n. 4, p. 512, doi. 10.1002/jcc.540160414

By:

Zhexin, Xiang;
Yunyu, Shi;
Yingwu, Xu

Publication type:

Article

Calculation of binding energy differences for receptor-ligand systems using the Poisson-Boltzmann method.

Published in:

Journal of Computational Chemistry, 1995, v. 16, n. 4, p. 445, doi. 10.1002/jcc.540160407

By:

Shen, Jian;
Quiocho, Florante A.

Publication type:

Article

Parallel computation of the MP2 energy on distributed memory computers.

Published in:

Journal of Computational Chemistry, 1995, v. 16, n. 4, p. 395, doi. 10.1002/jcc.540160402

By:

Márquez, Antonio M.;
Dupuis, Michel

Publication type:

Article

Parameterization and evaluation of a flexible water model.

Published in:

Journal of Computational Chemistry, 1995, v. 16, n. 4, p. 501, doi. 10.1002/jcc.540160413

By:

Ferguson, David M.

Publication type:

Article