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A New Computer-Oriented Approach to Molecular Mechanics
(University of Texas at Arlington, 1982-02)
**Please note that the full text is embargoed** ABSTRACT: A new dynamical theory for atomic and molecular dynamics is formulated and discussed. The associated nonlinear differential system is derived from general atomic ...
A Classical Molecular Approach to Computer Simulation of Biological Sorting
(University of Texas at Arlington, 1980-05)
**Please note that the full text is embargoed** ABSTRACT: Steinberg's theory of sorting is modified by replacing the free energy minimization principle with dynamical equations of a molecular nature. Correct cellular sorting ...
Computer Studies of the Classical Oxygen Molecule
(University of Texas at Arlington, 1980-03)
**Please note that the full text is embargoed** ABSTRACT: A classical, simplistic model of the molecular
dynamics of 02 is developed for interactions
which are not readily amenable to quantum
mechanical analysis. ...
Programs and Data Sets for Quasimolecular Modeling of Vortices
(University of Texas at Arlington, 1986-12)
**Please note that the full text is embargoed**
Programs and Data Sets for Quasimolecular Modeling of Cavity Flow
(University of Texas at Arlington, 1987-01)
**Please note that the full text is embargoed**
Supercomputer Simulation of the Modes of Colliding Microdrops of Water
(University of Texas at Arlington, 1990-09)
**Please note that the full text is embargoed**
Computer Studies of a Semiclassical Model of the Water Molecule
(University of Texas at Arlington, 1993)
**Please note that the full text is embargoed** ABSTRACT: A semiclassical model of the water molecule is formulated in
ground state as an eleven-body problem. The stiff system of
dynamical, nonlinear, ordinary differential ...
On Nonlinear Parameter Estimation in Least Squares Approximation
(University of Texas at Arlington, 1993-03)
**Please note that the full text is embargoed** ABSTRACT: A non-matrix form of Newton's method for systems of nonlinear
equations is described for nonlinear parameter estimation in
least squares approximation. Computer ...
Computer Study of a Semiclassical Model of the Dynamical Water Molecule
(University of Texas at Arlington, 1993-03)
**Please note that the full text is embargoed** ABSTRACT: A semiclassical model of the water molecule is formulated as an
eleven-body problem. The stiff system of differential equations
is run for two billion time steps ...
Electron Attraction as a Mechanism for the Chemical Bond of Ground State H2
(University of Texas at Arlington, 1993)
**Please note that the full text is embargoed** ABSTRACT: Previously, electron attraction, incorporated into classical models of the chemical bond, yielded correct bond lengths and vibrational frequencies for all the ...