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Volume 18; Issue 2
Main
Computers & Chemistry
Volume 18; Issue 2
Computers & Chemistry
Volume 18; Issue 2
1
A modified MM2 program for molecular mechanics calculations on coordination compounds
Paul C. Yates
,
Anna K. Marsden
Journal:
Computers & Chemistry
Year:
1994
Language:
english
File:
PDF, 402 KB
Your tags:
english, 1994
2
Quantitative perturbational molecular orbital analysis of the conformational preference of aniline molecule and its intramolecular force
Zhong Heng Yu
Journal:
Computers & Chemistry
Year:
1994
Language:
english
File:
PDF, 678 KB
Your tags:
english, 1994
3
Cluster analysis by simulated annealing
Li-Xian Sun
,
Yu-Long Xie
,
Xin-Hua Song
,
Ji-Hong Wang
,
Ru-Qin Yu
Journal:
Computers & Chemistry
Year:
1994
Language:
english
File:
PDF, 487 KB
Your tags:
english, 1994
4
Typesetting structural formulae with the text formatter TeX/LaTeX
Shinsaku Fujita
Journal:
Computers & Chemistry
Year:
1994
Language:
english
File:
PDF, 595 KB
Your tags:
english, 1994
5
Definition, mathematical examples and quantum chemical applications of nested summation symbols and logical Kronecker deltas
Ramon Carbó
,
Emili Besalú
Journal:
Computers & Chemistry
Year:
1994
Language:
english
File:
PDF, 999 KB
Your tags:
english, 1994
6
Gates towards evolutionary large-scale optimization: A software-oriented approach to genetic algorithms—I. General perspective
C.B. Lucasius
,
G. Kateman
Journal:
Computers & Chemistry
Year:
1994
Language:
english
File:
PDF, 1.12 MB
Your tags:
english, 1994
7
Gates towards evolutionary large-scale optimization: A software-oriented approach to genetic algorithms—II. Toolbox description
C.B. Lucasius
,
G. Kateman
Journal:
Computers & Chemistry
Year:
1994
Language:
english
File:
PDF, 2.05 MB
Your tags:
english, 1994
8
Using molecular representations in combination with neural networks. A case study: Prediction of the HPLC retention index
J.R.M. Smits
,
W.J. Melssen
,
G.J. Daalmans
,
G. Kateman
Journal:
Computers & Chemistry
Year:
1994
Language:
english
File:
PDF, 1.57 MB
Your tags:
english, 1994
9
A new development of the oasis computer system for modeling molecular properties
Ovanes G. Mekenyan
,
Stoyan H. Karabunarliev
,
Julian M. Ivanov
,
Dimitar N. Dimitrov
Journal:
Computers & Chemistry
Year:
1994
Language:
english
File:
PDF, 1.62 MB
Your tags:
english, 1994
10
Coding of chemical structures based on a line notation
Stoyan Karabunarliev
,
Julian Ivanov
,
Ovanes Mekenyan
Journal:
Computers & Chemistry
Year:
1994
Language:
english
File:
PDF, 344 KB
Your tags:
english, 1994
11
A computer program for the simulation of Boxcar Integrator and Averager system in luminescence decay kinetic experiments
João B.Marques Novo
,
Francisco B.T. Pessine
Journal:
Computers & Chemistry
Year:
1994
Language:
english
File:
PDF, 251 KB
Your tags:
english, 1994
12
Game: Genetic algorithm for minimization of energy, an interactive program for three-dimensional intermolecular interactions
Y.L. Xiao
,
D.E. Williams
Journal:
Computers & Chemistry
Year:
1994
Language:
english
File:
PDF, 270 KB
Your tags:
english, 1994
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