Volume 21,
Number 1,
1997
Volume 21,
Number 2,
1997
- William G. Bardsley, Nalli Prasad:
Using ASCII Text Files in Post-fix Notation (reverse Polish) to Define Mathematical Models and Systems of Differential Equations for Simulation and Non-linear Regression.
71-82
Electronic Edition (link) BibTeX
- Roman Wojsz, Artur P. Terzyk:
The Structural Parameters of Microporous Solid, Including Fractal Dimension, on the Basis of the Potential Theory of Adsorption - the General Solution.
83-87
Electronic Edition (link) BibTeX
- Adam Liwo, Piotr Skurski, Stanislaw Oldziej, Leszek Lankiewicz, Joanna Malicka, Wieslaw Wiczk:
A New Approach to the Resolution of the Excitation-emission Spectra of Multicomponent Systems.
89-95
Electronic Edition (link) BibTeX
- Dieter Britz:
Stability of the Backward Differentiation Formula (FIRM) Applied to Electrochemical Digital Simulation.
97-108
Electronic Edition (link) BibTeX
- Dezhao Chen, Yaqiu Chen, Shangxu Hu:
A Pattern Classification Procedure Integrating the Multivariate Statistical Analysis with Neural Networks.
109-113
Electronic Edition (link) BibTeX
- Jonathan Edwards, Greg Chatham, William Kile Glunt, Daniel McDonald, Chris Wells, Tom L. Hayden:
Sampling Properties of the Alternating Projection Distance Geometry Algorithm Applied to Unconstrained Polypeptide Chains.
115-124
Electronic Edition (link) BibTeX
- Tom E. Simos:
Accurate Computations for the Elastic Scattering Phase-shift Problem.
125-128
Electronic Edition (link) BibTeX
Volume 21,
Number 3,
1997
Volume 21,
Number 4,
1997
Volume 21,
Number 5,
1997
- Antoine H. C. van Kampen, Mischa L. M. Beckers, Lutgarde M. C. Buydens:
A Comparative Study of the DG-OMEGA (DG), DGII, and GAT Method for the Structure Elucidation of a Methylene-acetal Linked Thymine Dinucleotide.
281-297
Electronic Edition (link) BibTeX
- Ramachandra Bhat:
Isotope Pattern Simulation in the Mass Spectrum of Multinuclear Organometallic Clusters.
299-303
Electronic Edition (link) BibTeX
- Eduardo A. Castro:
Improved Simple Protocols to Calculate Hydrocarbon Enthalpies of Formation From Ab Initio Total Energies.
305-308
Electronic Edition (link) BibTeX
- Georgi P. Vassilev, Christo T. Daiev:
Simulation of the Underground Migration of Nuclides From Radioactive Wastes.
309-313
Electronic Edition (link) BibTeX
- A. Natarajan, N. Mohankumar:
An Algorithm for the Numerical Evaluation of the Randles-Sevcik Function.
315-318
Electronic Edition (link) BibTeX
- Gyula Tasi, Fujio Mizukami, István Pálinkó:
A New Program for Effective One-electron (EHMO-ASED) Calculations.
319-325
Electronic Edition (link) BibTeX
- Tom E. Simos, G. Tougelidis:
An Explicit Eighth-order Method with Minimal Phase-lag for Accurate Computations of Eigenvalues, Resonances and Phase Shifts.
327-334
Electronic Edition (link) BibTeX
- Zhang Ruisheng, Liu Shuhui, Liu Mancang, Hu Zhide:
Neural Network-molecular Descriptors Approach to the Prediction of Properties of Alkenes.
335-341
Electronic Edition (link) BibTeX
- Jacques Gabarro-Arpa, Marc Le Bret, A. Marcouyoux:
Cadira: An Object-oriented Platform for Modelling Molecules and Analyzing Simulzations.
343-345
Electronic Edition (link) BibTeX
- Slawomir Berski, Zdzislaw Latajka:
On the Role of the Basis Set and Electron Correlation in the Description of Stacking Interactions.
347-354
Electronic Edition (link) BibTeX
Volume 21,
Number 6,
1997
- Mijo Vedrina, Stribor Markovi, Marica Medi-ari, Nenad Trinajstic:
TAM: A Program for the Calculation of Topological Indices in QSPR and QSAR Studies.
355-361
Electronic Edition (link) BibTeX
- Fabio E. Penotti:
On the Effect of Potential-energy Cubic-spline Interpolation Error on Numerov-Cooley Diatomic Rovibrational Levels.
363-367
Electronic Edition (link) BibTeX
- Jerzy Szczygiel, Marek Stolarski:
Mathematical Analysis of the Depolymerization of Asphaltenes From Coal Extract.
369-375
Electronic Edition (link) BibTeX
- Mischa L. M. Beckers, Willem J. Melssen, Lutgarde M. C. Buydens:
A Self-organizing Feature Map for Clustering Nucleic Acids Application to a Data Matrix Containing A-DNA and B-DNA Dinucleotides.
377-390
Electronic Edition (link) BibTeX
- Leslaw K. Bieniasz, Ole Østerby, Dieter Britz:
The Effect of the Discretization of the Mixed Boundary Conditions on the Numerical Stability of the Crank-Nicolson Algorithm of Electrochemical Kinetic Simulations.
391-401
Electronic Edition (link) BibTeX
- Tom E. Simos, Paul Stefan Williams:
A Family of Numerov-type Exponentially Fitted Methods for the Numerical Integration of the Schrödinger Equation.
403-417
Electronic Edition (link) BibTeX
- Pavel Jungwirth, Erick Fredj, Petra Dánská, R. Benny Gerber:
Quantum Dynamics of Large Polyatomic Systems Using Classical Separable Potentials: The Computational Implementation.
419-429
Electronic Edition (link) BibTeX
- Ludovic Mouron, Gilles Roullet, Jean-Jacques Legendre, Gérard Picard:
Computational Evidence of Complexes in Structural Models of Melts Deriving From Neutron Diffraction Data.
431-435
Electronic Edition (link) BibTeX
- Ovidiu Ivanciuc, Jean-Pierre Rabine, Daniel Cabrol-Bass:
13C NMR Chemical Shift Sum Prediction for Alkanes Using Neural Networks.
437-443
Electronic Edition (link) BibTeX
- Grazyna Nowak:
Approximate Reasoning of the Chemical Reactivity for Computer Simulation of Chemical Reactions.
445-451
Electronic Edition (link) BibTeX
Copyright © Sat May 16 23:52:17 2009
by Michael Ley (ley@uni-trier.de)