You limited your search to:

 Collection: UNT Theses and Dissertations
Metals in Chemistry and Biology: Computational Chemistry Studies

Metals in Chemistry and Biology: Computational Chemistry Studies

Date: May 2007
Creator: Dinescu, Adriana
Description: Numerous enzymatic reactions are controlled by the chemistry of metallic ions. This dissertation investigates the electronic properties of three transition metal (copper, chromium, and nickel) complexes and describes modeling studies performed on glutathione synthetase. (1) Copper nitrene complexes were computationally characterized, as these complexes have yet to be experimentally isolated. (2) Multireference calculations were carried out on a symmetric C2v chromium dimer derived from the crystal structure of the [(tBu3SiO)Cr(µ-OSitBu3)]2 complex. (3) The T-shaped geometry of a three-coordinate β-diketiminate nickel(I) complex with a CO ligand was compared and contrasted with isoelectronic and isosteric copper(II) complexes. (4) Glutathione synthetase (GS), an enzyme that belongs to the ATP-grasp superfamily, catalyzes the (Mg, ATP)-dependent biosynthesis of glutathione (GSH) from γ-glutamylcysteine and glycine. The free and reactant forms of human GS (wild-type and glycine mutants) were modeled computationally by employing molecular dynamics simulations, as these currently have not been structurally characterized.
Contributing Partner: UNT Libraries
Metamodeling-based Fast Optimization of  Nanoscale Ams-socs

Metamodeling-based Fast Optimization of Nanoscale Ams-socs

Date: May 2012
Creator: Garitselov, Oleg
Description: Modern consumer electronic systems are mostly based on analog and digital circuits and are designed as analog/mixed-signal systems on chip (AMS-SoCs). the integration of analog and digital circuits on the same die makes the system cost effective. in AMS-SoCs, analog and mixed-signal portions have not traditionally received much attention due to their complexity. As the fabrication technology advances, the simulation times for AMS-SoC circuits become more complex and take significant amounts of time. the time allocated for the circuit design and optimization creates a need to reduce the simulation time. the time constraints placed on designers are imposed by the ever-shortening time to market and non-recurrent cost of the chip. This dissertation proposes the use of a novel method, called metamodeling, and intelligent optimization algorithms to reduce the design time. Metamodel-based ultra-fast design flows are proposed and investigated. Metamodel creation is a one time process and relies on fast sampling through accurate parasitic-aware simulations. One of the targets of this dissertation is to minimize the sample size while retaining the accuracy of the model. in order to achieve this goal, different statistical sampling techniques are explored and applied to various AMS-SoC circuits. Also, different metamodel functions are explored for their ...
Contributing Partner: UNT Libraries
Metamorphosis: William Faulkner's Incorporation of Short Stories into Longer Narratives

Metamorphosis: William Faulkner's Incorporation of Short Stories into Longer Narratives

Date: January 1961
Creator: Faught, Patsy Kelley
Description: This study analyzes these stories in their original and later forms, both to discover the types of changes Faulkner made and to determine whether or not he followed any pattern in the revisions.
Contributing Partner: UNT Libraries
“A Metaphor for the Impossibility of Togetherness”: Expansion Processes in Gubaidulina’s First String Quartet

“A Metaphor for the Impossibility of Togetherness”: Expansion Processes in Gubaidulina’s First String Quartet

Date: August 2012
Creator: Stroud, Cara
Description: This thesis illustrates how I hear processes of expansion organizing musical materials in the First String Quartet. By employing a flexible approach to expansion and developing models of wedge and additive expansions beyond the bounds of specific voice-leading or rhythmic augmentation procedures, expansion processes can be understood in each of the varied episodes of the quartet. Gubaidulina’s use of expansion processes, embodied organically in pitch, rhythm, form, and physical space, unifies the episodic materials of the First String Quartet and provides an inevitable conclusion to the work’s loose narrative.
Contributing Partner: UNT Libraries
Metaphors, Myths, and Archetypes: Equal Paradigmatic Functions in Human Cognition?

Metaphors, Myths, and Archetypes: Equal Paradigmatic Functions in Human Cognition?

Access: Use of this item is restricted to the UNT Community.
Date: December 2002
Creator: Kalpakidis, Charalabos
Description: The overview of contributions to metaphor theory in Chapters 1 and 2, examined in reference to recent scholarship, suggests that the current theory of metaphor derives from long-standing traditions that regard metaphor as a crucial process of cognition. This overview calls to attention the necessity of a closer inspection of previous theories of metaphor. Chapter 3 takes initial steps in synthesizing views of domains of inquiry into cognitive processes of the human mind. It draws from cognitive models developed in linguistics and anthropology, taking into account hypotheses put forth by psychologists like Jung. It sets the stage for an analysis that intends to further understanding of how the East-West dichotomy guides, influences, and expresses cognitive processes. Although linguist George Lakoff denies the existence of a connection between metaphors, myths, and archetypes, Chapter 3 illustrates the possibility of a relationship among these phenomena. By synthesizing theoretical approaches, Chapter 3 initiates the development of a model suitable for the analysis of the East-West dichotomy as exercised in Chapter 4. As purely emergent from bodily experience, however, neither the concept of the East nor the concept of the West can be understood completely. There exist cultural experiences that may, depending on historical and ...
Contributing Partner: UNT Libraries
A Method for Approximating the Distributed Loads of an Airplane by Sets of Point Loads

A Method for Approximating the Distributed Loads of an Airplane by Sets of Point Loads

Date: 1957
Creator: Austin, Charles Wayne
Description: This paper gives the derivation of a method for determining the forces to be applied to these points which will simulate the load distributed over all the airplane.
Contributing Partner: UNT Libraries
A Method for Calculating Foil Depression Factors

A Method for Calculating Foil Depression Factors

Date: June 1953
Creator: Workman, Billy J.
Description: As disc-shaped detectors are one of the primary means of measuring the neutron density, a better solution is desirable if the error due to the depression factor is to be made negligible. In this paper, an attempt is made to solve this problem in the oblate spheroidal co-ordinate system which most nearly describes the disc-shaped detector, so that solutions may be obtained that describe depression factors for detectors of varying thicknesses and radii.
Contributing Partner: UNT Libraries
A Method of Analyzing Linear Perspective for Presentation to Junior and Senior High School Students

A Method of Analyzing Linear Perspective for Presentation to Junior and Senior High School Students

Date: 1950
Creator: Lacy, L'Louise Dial
Description: The general purpose of this study is to develop a series of peep shows, or visual models, which will enable the young student to understand what the laws of perspective are, how they were found, and why his drawings will appear to have three dimensions if he follows the rules. The study is based upon a widely accepted idea--that it is much easier for most people to understand and remember a principle when they can actually see how it works. When rules are merely memorized, one is not assisted by reason, which is essential for useful retention.
Contributing Partner: UNT Libraries
A Method of Analyzing Trends in Modern Painting for Presentation to High-School Students

A Method of Analyzing Trends in Modern Painting for Presentation to High-School Students

Date: 1948
Creator: Brewster, Janie Lou Klepper
Description: In developing the study, the writer has attempted to devise a method whereby high-school students may gain an understanding of certain trends in modern abstract and non-objective painting.
Contributing Partner: UNT Libraries
Methodological Issues in Malingering Research: The Use of Simulation Designs

Methodological Issues in Malingering Research: The Use of Simulation Designs

Date: December 2010
Creator: Gillard, Nathan D.
Description: The accurate determination of malingering relies on the use of validated and clinically relevant assessment measures. Simulation design is the most often-used research design to accomplish this. However, its external validity is sometimes questioned. The goal of the thesis was to systematically evaluate these major elements: situation, incentives, and coaching. The situation in simulation studies can vary from relevant (academic failure in a college population) to irrelevant (capital murder) for the samples being studied. Incentives refer to the external motivation given to improve simulators' performance and can be positive (extra credit and monetary reward) or negative (extra time and effort). Finally, coaching refers to whether the participant receives any information on detection strategies that are designed to identify feigners. Using a large undergraduate sample in a factorial design, results indicate that a scenario familiar to the participants generally improved the believability of their responses. Coaching also improved the ability to feign convincingly, while incentive type was not associated with any change in scores. The implications of these findings for future research designs and the connection to practice are discussed.
Contributing Partner: UNT Libraries