Synthesis and comparative molecular field analysis (CoMFA) of antitumor 3-arylisoquinoline derivatives

In this study a series of 3-arylisoquinoline derivatives were synthesized and cytotoxicity against human melanoma tumor cell evaluated, and a three dimensional quantitative structure-activity relationship was investigated using the comparative molecular field analysis (CoMFA). The results suggested that the electrostatic, steric and hydrophobic factors of 3-arylisoquinolines were strongly correlated with the antitumor activity. Considerable predictive ability (cross-validated r2 as high as 0.721) was obtained through CoMFA.     

ANALYSIS OF EXPERIMENTAL AND NUMERICAL RESULTS OF A TURBULENT SWIRLING FLOW IN A TUBE

In many applications swirling flow is used to enhance heat and mass transfer. One of the problems of modelling a turbulent swirling flow is the choice of the turbulent closure model which is acceptable for engineering purposes. To evaluate which model performs best, numerical results are compared with experimental data. Local velocity measurements are carried out on a swirling flow in a circular tube. The measurement method is hot-wire anemometry combined with visualization techniques. The numerical analysis is carried out using the k-ε model and the Algebraic Stress Model. In the experiment a symmetrical swirl was observed, Comparing the experimental data with the numerical results shows that the Algebraic Stress Model represents the experimental data quite well, whereas the k-ε model fails.     

Trp82 and Tyr332 are involved in two quaternary ammonium binding domains of human butyrylcholinesterase as revealed by photoaffinity labeling with [3H]DDF

Purified butyrylcholinesterase (BuChE) was photolabeled by [3H]-p-N, N-dimethylamino benzene diazonium ([3H]DDF) to identify the quaternary ammonium binding sites on this protein [Ehret-Sabatier, L. , Schalk, I., Goeldner, M., and Hirth, C. (1992) Eur. J. Biochem. 203, 475-481]. The covalent photoincorporation occurs with a stoichiometry of one mole of probe per mole of inactivated site and could be fully prevented by several cholinergic inhibitors such as tacrine or tetramethylammonium. After complete deglycosylation of the enzyme using N-glycosidase F, the alkylated protein was trypsinolyzed and the digests were analyzed by HPLC coupled to ES-MS. A direct comparison of tryptic fragments from labeled and unlabeled BuChE allowed us to identify the tryptic peptide Tyr61-Lys103 as carrying the probe. Purification of the labeled peptides by anion-exchange chromatography gave a major radioactive peak which was further fractionated by reversed-phase HPLC leading to three, well-resolved, radioactive peaks. Microsequencing revealed that two of these peaks contained an overlapping sequence starting at Tyr61, while the third peak contained a sequence extending from Thr315. Radioactive signals could be unambiguously attributed to positions corresponding to residues Trp82 and Tyr332. This labeling study establishes the existence of two different binding domains for quaternary ammonium in BuChE and exemplifies additional cation/pi interactions in cholinergic proteins. This work strongly supports the existence of a peripheral anionic site in BuChE, implying residue Tyr332 as a key element.     

Hybrid cam mechanisms

This paper investigates the problem of driving a machine with several reciprocating heavy inertias. The drive should also realize some programmable flexibility of the motion, so that the operation of the machine, e,g., synchronization between different motions and duration of standstills, can easily be modified. The use of a single servomotor for every motion is not the best solution, since it does not allow for energy recuperation. This means that the installed servomotor power will be much higher than the required net peak power for the machine as a whole. The presented solution, however, reduces the servomotor peak torque and power by one order of magnitude, and makes energy transfer between the motions possible. The hybrid cam mechanism consists of a hybrid drive, which is a combination of a servomotor, a constant velocity motor and a cam follower mechanism. The operation principle exploits the nonlinear characteristics of the cam to add flexibility at low cost of energy. The hybrid solution is particularly successful for motions involving high peak acceleration. In addition, the concept can be used to reject disturbances. Simulations show the performance of the hybrid cam mechanism.     

Tailored versus realistic geometry in the inverse problem ofelectrocardiography

The stability and applicability of a previously developed inverse procedure for the noninvasive determination of the activation sequence of the human heart has been evaluated. In particular, the possibility of using a standard geometrical configuration representing the heart and the inhomogeneous volume conductor in this procedure has been tested. Results show that in order to obtain reliable inverse solutions, true "tailored" geometry should be used.     

Noise and dynamic range optimization of SAW transversal filters

A model for surface acoustic wave (SAW) transversal filters with special attention to the system and circuit designer's point of view is summarized. In the ideal situation the SAW transversal filter is driven with a voltage and the short-circuit current is sensed, which results in a minimization of the triple transit echo distortion. The aperture (width) of the SAW device is the only parameter that is not determined by the frequency dependence of the transfer and therefore it can be used to optimize the SAW device in relation to the electronic circuitry. Noise and dynamic range calculations on an amplifier-filter-amplifier configuration, are performed. It is shown that for a low noise floor at the input of the SAW device, the aperture of this device should be chosen large. However, the dynamic range of the amplifier-filter-amplifier configuration can be maximized by choosing a small aperture.