Thermal degradation behavior of some ruthenium complexes with fluoroquinolone derivatives as potential antitumor agents

Three new complexes with ligands belong to the fluoroquinolone class having the general formula [RuL₂Cl₂]Cl nH₂O ((1) L: norfloxacin (nf), n = 4; (2) L: ciprofloxacin (cp), n = 3; (3) L: enrofloxacin (enro), n = 5) were synthesized and characterized by chemical analysis UV–Vis and IR spectroscopy. In all complexes fluoroquinolone derivative acts as bidentate chelate ligand. The thermal behavior steps were investigated in synthetic air flow. The thermal transformations are complex processes according to TG and DTG curves including dehydration, quinolone derivative degradation, as well as RuCl₃ conversion in RuO₂.     

Testing Monotonicity

at arguments of its choice, the test always accepts a monotone f, and rejects f with high probability if it is ε-far from being monotone (i.e., every monotone function differs from f on more than an ε fraction of the domain). The complexity of the test is O(n/ε). The analysis of our algorithm relates two natural combinatorial quantities that can be measured with respect to a Boolean function; one being global to the function and the other being local to it. A key ingredient is the use of a switching (or sorting) operator on functions. Received March 29, 1999     

Long range correlation of hydrophilicity and flexibility along the calcium binding protein chains

Long range correlation concerning hydrophilicity and flexibility along a number of 80 calcium binding protein sequences is confirmed by using spectral analysis and detrended fluctuations analysis methods, as well as by Hurst exponent calculations. There are no significant differences between the correlation properties concerning these properties for the two structural subfamilies, extended and compact, of the calcium binding proteins and they are also similar with the correlation properties revealed by other investigated proteins. This result sustains the hypothesis that the long range correlation of hydrophilicity and flexibility along the chain is a common feature of proteins.     

Dynamic data structures for fat objects and their applications

We present several efficient dynamic data structures for point-enclosure queries, involving convex fat objects in or . Our planar structures are actually fitted for a more general class of objects – (β,δ)-covered objects – which are not necessarily convex, see definition below. These structures are more efficient than alternative known structures, because they exploit the fatness of the objects. We then apply these structures to obtain efficient solutions to two problems: (i) finding a perfect containment matching between a set of points and a set of convex fat objects, and (ii) finding a piercing set for a collection of convex fat objects, whose size is optimal up to some constant factor.     

A new domain decomposition method with overlapping patches for ultrascale simulations: Application to biological flows

We address the failure in scalability of large-scale parallel simulations that are based on (semi-)implicit time-stepping and hence on the solution of linear systems on thousands of processors. We develop a general algorithmic framework based on domain decomposition that removes the scalability limitations and leads to optimal allocation of available computational resources. It is a non-intrusive approach as it does not require modification of existing codes. Specifically, we present here a two-stage domain decomposition method for the Navier–Stokes equations that combines features of discontinuous and continuous Galerkin formulations. At the first stage the domain is subdivided into overlapping patches and within each patch a C⁰ spectral element discretization (second stage) is employed. Solution within each patch is obtained separately by applying an efficient parallel solver. Proper inter-patch boundary conditions are developed to provide solution continuity, while a Multilevel Communicating Interface (MCI) is developed to provide efficient communication between the non-overlapping groups of processors of each patch. The overall strong scaling of the method depends on the number of patches and on the scalability of the standard solver within each patch. This dual path to scalability provides great flexibility in balancing accuracy with parallel efficiency. The accuracy of the method has been evaluated in solutions of steady and unsteady 3D flow problems including blood flow in the human intracranial arterial tree. Benchmarks on BlueGene/P, CRAY XT5 and Sun Constellation Linux Cluster have demonstrated good performance on up to 96,000 cores, solving up to 8.21B degrees of freedom in unsteady flow problem. The proposed method is general and can be potentially used with other discretization methods or in other applications.     

Tris[2‐(morpholin‐4‐ylmethyl)phenyl‐κ2C1,N]antimony(III)

The title compound, [Sb(C₁₁H₁₄NO)₃], is monomeric with the Sb atom located on a threefold axis. The complex exhibits distorted trigonal–antiprismatic geometry around the Sb atom, owing to the presence of intramolecular N→Sb interactions. H...phenyl intermolecular interactions lead to the formation of dimers stacked along the c axis. The morpholine rings exhibit almost ideal chair conformations. No intermolecular interactions between the morpholine rings of neighbouring molecules were observed.     

The longest cycle of a graph with a large minimal degree

We show that every graph G on n vertices with minimal degree at least n/k contains a cycle of length at least [n/(k ? 1)]. This verifies a conjecture of Katchalski. When k = 2 our result reduces to the classical theorem of Dirac that asserts that if all degrees are at least 1/2n then G is Hamiltonian.     

Blends of a chlorinated poly(vinyl chloride) with a polyurethane

Blends of a 67% chlorinated poly(vinyl chloride) with a low-molecular-weight polyurethane are partially miscible over the 0–80% urethane compositional range. A single, composition-dependent glass transition temperature is observed from both DSC and dynamic mechanical measurements. The blends exhibit a cocontinuous morphology with domain sizes varying from 0.15 to 1.5 μm. These results point out that the relation between miscibility characteristics and domain size is a complex one, not only dependent upon the degree of miscibility, but also on the nature of the blend components and the test method used. Thus the domain size for a certain degree of miscibility is not a universal constant as was previously believed. The melt rheology of the blends as a function of composition is strongly “positive deviating” from the log additivity rule and fits a simplified version of the McAllister model. The strongly “positive deviating” rheological behavior of the blends is most likely a result of the cocontinuous morphology which makes the system behave as a highly entangled network.