The phase diagram of a single polymer chain: New insights from a new simulation method

We present simulation results for the phase behavior of a single chain for a flexible lattice polymer model using the Wang-Landau sampling idea. Applying this new algorithm to the problem of the homopolymer collapse allows us to investigate not only the high temperature coil–globule transition but also an ensuing crystallization at lower temperature. Performing a finite size scaling analysis on the two transitions, we show that they coincide for our model in the thermodynamic limit corresponding to a direct collapse of the random coil into the crystal without intermediate coil–globule transition. As a consequence, also the many chain phase diagram of this model can be predicted to consist only of gas and crystal phase in the limit of infinite chain length. This behavior is in agreement with findings on the phase behavior of hard-sphere systems with a relatively short-ranged attractive square well. © 2006 Wiley Periodicals, Inc. J Polym Sci Part B: Polym Phys 44: 2542–2555, 2006     

Practical syntheses of [1,3,5]‐triazine dendritic molecules on solid supports

A practical and divergent synthesis of supported [1,3,5]‐triazine dendritic molecules on Wang resin, PEGA resin, SynPhase? Lanterns, and silica gel is described. The alkylamine linkers used allow derivatization with functionality for both synthetic (e.g., supported reagent and scavenger activity) and chemical biology applications. The use of supported intermediates allows differentiation of symmetric linkers without the need for protecting group chemistry. The synthetic route uses inexpensive, readily available starting materials in a straightforward and scaleable strategy. © 2006 Wiley Periodicals, Inc. J Polym Sci Part A: Polym Chem 44: 2248–2259, 2006     

Di-jet shape modification in heavy ion collisions

We present preliminary results from intermediate p _T(1–5 GeV/c) di-hadron azimuthal correlations induced by hadronic di-jets produced in AuAu collisions at √s _NN =200 GeV. The near-side (Δ?～0) has a typical singlepeaked structure which broadens with the centrality of the collision. A qualitatively new phenomenon shows up in the shape of the away-side (Δ?～π): it has a symmetric, double-peaked structure in central and mid-central collisions.     

When maths really is rocket science

Two problems in projectiles are discussed which generate interestingloci.     

Determination of phosphorus in steels by radiochemical neutron activation analysis

The viability of radiochemical neutron activation analysis as a method for certification of phosphorus in steels was tested by analysis of SRM low alloy steels. Preliminary results are generally in agreement with certified values. The limit of detection, as defined by Currie¹, was determined to be 5 μg/kg.     

On conservative approximation by linear polynomial operators an extension of the Bernstein's operator

In this work we study linear polynomial operators preserving some consecutive i-convexities and leaving invariant the polynomials up to a certain degree. First, we study the existence of an incom patibility between the conservation of certain i-convexities and the invariance of a space of polynomials. Interpolation properties are obtained and a theorem by Berens and DeVore about the Bernstein's operator is extended. Finally, from these results a generalized Bernstein's operator is obtained. This work was supported by Junta de Andalucia. Grupo de investigación: Matemática Aplicada. Código: 1107     

Degeneracy in NLP and the development of results motivated by its presence

We study notions of nondegeneracy and several levels of increasing degeneracy from the perspective of the local behavior of a local solution of a nonlinear program when problem parameters are slightly perturbed. Ideal nondegeneracy at a local minimizer is taken to mean satisfaction of second order sufficient conditions, linear independence and strict complimentary slackness. Following a brief exploration of the relationship of these conditions with the classical definition of nondegeneracy in linear programming, we recall a number of optimality and regularity conditions used to attempt to resolve degeneracy and survey results of Fiacco, McCormick, Robinson, Kojima, Gauvin and Janin, Shapiro, Kyparisis and Liu. This overview may be viewed as a structured survey of sensitivity and stability results: the focus is on progressive levels of degeneracy. We note connections of nondegeneracy with the convergence of algorithms and observe the striking parallel between the effects of nondegeneracy and degeneracy on optimality conditions, stability analysis and algorithmic convergence behavior. Although our orientation here is primarily interpretive and noncritical, we conclude that more effort is needed to unify optimality, stability and convergence theory and more results are needed in all three areas for radically degenerate problems.Research supported by National Science Foundation Grant ECS 90-00560 and Grant N00014-89-J-1537 Office of Naval Research