NMR AND DFT STUDY OF Co-C BOND ACTIVATION MECHANISM IN VITAMIN B_(12) COMPOUNDS

This report focuses on a theoretical study of the cobalt-cabon bond activation mechanism in Vitamin B12, its co enzyme complexes, and model compounds such as cobalamins (Cbl), cobaloximes and cobalt porphyrins. In particular, emphasis is placed on the nucleotide loop and its role in the base on and base off mechanism.     

Fluid and diffusion limits for transient sojourn times of processor sharing queues with time varying rates

We provide an approximate analysis of the transient sojourn time for a processor sharing queue with time varying arrival and service rates, where the load can vary over time, including periods of overload. Using the same asymptotic technique as uniform acceleration as demonstrated in [12] and [13], we obtain fluid and diffusion limits for the sojourn time of the M_t/M_t/1 processor-sharing queue. Our analysis is enabled by the introduction of a “virtual customer” which differs from the notion of a “tagged customer” in that the former has no effect on the processing time of the other customers in the system. Our analysis generalizes to non-exponential service and interarrival times, when the fluid and diffusion limits for the queueing process are known.     

A power-law distribution for tenure lengths of sports managers

We show that the tenure lengths for managers of sport teams follow a power law distribution with an exponent between 2 and 3. We develop a simple theoretical model which replicates this result. The model demonstrates that the empirical phenomenon can be understood as the macroscopic outcome of pairwise interactions among managers in a league, threshold effects in managerial performance evaluation, competitive market forces, and luck at the microscopic level.     

The analysis of volatile trace compounds in landfill gases,compost heaps and forest air

Landfill gas, cryotrapped on a loop fashioned from a length of a capillary gas chromatography (GC) column, was examined for volatile organometallic compounds (VOMCs) and for volatile organic compounds (VOCs) by using GC–mass spectrometry (MS). A large number of organic components were present and many were identified, but the only VOMCs present in high enough concentrations to be detected were trimethylstibine and tetramethyltin. The use of inductively coupled plasma (ICP)‐MS as an element‐specific detector allowed the identification of a number of other organometallic species in the landfill gas, including trimethylarsine and trimethylbismuth, and, for the first time, butyltrimethyltin and dibutyldimethyltin. The presence of molybdenum hexacarbonyl was confirmed. Gas from a large‐scale compost heap and from compost incubated in the laboratory contained iodomethane but no common VOMCs (GC–ICP‐MS). Only VOCs were present in forest air (GC–MS). Copyright © 2003 John Wiley & Sons, Ltd.     

Zeros of functions with finite Dirichlet integral

In this paper, we refine a result of Nagel, Rudin, and Shapiro (1982) concerning the zeros of holomorphic functions on the unit disk with finite Dirichlet integral.

     

Restructuring ordered binary trees

We consider the problem of restructuring an ordered binary tree T, preserving the in-order sequence of its nodes, so as to reduce its height to some target value h. Such a restructuring necessarily involves the downward displacement of some of the nodes of T. Our results, focusing both on the maximum displacement over all nodes and on the maximum displacement over leaves only, provide (i) an explicit tradeoff between the worst-case displacement and the height restriction (including a family of trees that exhibit the worst-case displacements) and (ii) efficient algorithms to achieve height-restricted restructuring while minimizing the maximum node displacement.     

The harmonic consistency index for the analytic hierarchy process

A new consistency measure, the harmonic consistency index, is obtained for any positive reciprocal matrix in the analytic hierarchy process. We show how this index varies with changes in any matrix element. A tight upper bound is provided for this new consistency measure when the entries of matrix are at most 9, as is often recommended. Using simulation, the harmonic consistency index is shown to give numerical values similar to the standard consistency index but it is easier to compute and interpret. In addition, new properties of the column sums of reciprocal matrices are obtained.     

Linear matrix inequality representation of sets

This article concerns the question, Which subsets of ?^m can be represented with linear matrix inequalities (LMIs)? This gives some perspective on the scope and limitations of one of the most powerful techniques commonly used in control theory. Also, before having much hope of representing engineering problems as LMIs by automatic methods, one needs a good idea of which problems can and cannot be represented by LMIs. Little is currently known about such problems. In this article we give a necessary condition that we call “rigid convexity,” which must hold for a set ?? ? ?^m in order for ?? to have an LMI representation. Rigid convexity is proved to be necessary and sufficient when m = 2. This settles a question formally stated by Pablo Parrilo and Berndt Sturmfels in [15]. As shown by Lewis, Parillo, and Ramana [11], our main result also establishes (in the case of three variables) a 1958 conjecture by Peter Lax on hyperbolic polynomials. © 2006 Wiley Periodicals, Inc.