Effects of international collaboration and status of journal on impact of papers

This study examines the effect of international collaboration of Slovenian authors and the status of journals where papers are published (as determined by their impact factors) on the impact of papers as measured by the number of citations papers receive. Research programme groups working in Slovenia in the 2004–2008 period in the fields of physics, chemistry, biology, biotechnology, and medical science were used for analyses. The results of the analyses show that the effects of the two factors differ among the fields. We discuss possible reasons for this, including the possibility that differences are the result of Slovenia’s science policy.     

Membrane concentration potentials across heavy metal soap membranes

The alumina mixed copper soap pellets of different fatty acids (C₆−C₁₆) have been prepared. The pellets are used as membranes of electropositive character. The concentration potential studies have been carried out with potassium chloride solutions. Transport number of counterions and selective ionic permeability through these membranes have been calculated. The values of both these parameters increase with increase in the number of C-atoms of the hydrocarbon chain of copper soaps. This seems to be due to lowering in solubility and increase in crosslinking in the membrane material.     

Strong Hydrogen Bonds in Acetylenedicarboxylic Acid Dihydrate

Acetylenedicarboxylic acid dihydrate (ADAD) represents a complex with strong hydrogen bonding between the carboxylic OH and the water molecule. An X-ray re-examination of the ADAD crystal structure confirms the O^…O distance of the short hydrogen bonds, and clearly shows different bond lengths between the two oxygen atoms with respect to the carbon atom in the carboxyl group, indicating a neutral structure for the complex. The neutral structure was also confirmed by vibrational spectroscopy, as no proton transfer was observed. The diffraction studies also revealed two polymorph modifications: room temperature (α) and low temperature (β), with a phase transition at approximately 4.9 °C. The calculated vibrational spectra are in satisfactory agreement with the experimental spectra. A comparison of the structure and the vibrational spectra between the ADAD and the oxalic acid dihydrate reveals some interesting details. The crystal structures of both crystal hydrates are almost identical; only the O^…O distances of the strongest hydrogen bonds differ by 0.08 Å. Although it was expected that a larger O^…O spacing in the ADAD crystal may significantly change the infrared and Raman spectra, especially for the frequency and the shape of the acidic OH stretching vibration, both the shape and frequency are almost identical, with all subpeaks topped on the broad OH stretching vibration. The O^…O distance dependent are only in- and out-of-plane OH deformations modes. The presence of polarons due to the ionized defects was not observed in the vibrational spectra of ADAD. Therefore, the origin of the broad OH band shape was explained in a similar way to the acid dimers. The anharmonicity of a potential enhances the coupling of the OH stretching with the low-frequency hydrogen bond stretching, which, in addition to the Fermi resonance, structures the band shape of the OH stretching. The fine structure found as a superposition of a broad OH stretching is attributed to Davydov coupling.     

Modeling, identification, and validation of models for predictive ammonia control in a wastewater treatment plant--a case study

The aim of this work is to develop the ammonia models that could be used for model predictive control (MPC) of nitrification process in a wastewater treatment plant. First, a reduced nonlinear model is presented, which is based on expression for nitrification reaction rate in activated sludge model No. 1 and modified for attached biomass processes, while second, a linear black-box model is shown. The data used for model identification were collected during several weeks of experiments on a real plant so that good identification data were obtained. The designed models were validated based on open loop simulations and predictions. Validation results show that the reduced nonlinear model performs better compared to the linear model, however, both models show relatively large errors compared to the real plant data. Hence, a closed loop simulation study was performed to see the differences between the performance of model predictive controller using previously estimated linear and nonlinear models and a standard proportional integral (PI) controller. From the simulation study results it was seen that in spite of relatively large model errors the MPC algorithms give better results in terms of ammonia removal compared to the PI controller, while MPC with the nonlinear model shows additional improvements over the MPC with the linear model.     

Why Monoamine Oxidase B Preferably Metabolizes N-Methylhistamine over Histamine: Evidence from the Multiscale Simulation of the Rate-Limiting Step

Histamine levels in the human brain are controlled by rather peculiar metabolic pathways. In the first step, histamine is enzymatically methylated at its imidazole N^τ atom, and the produced N-methylhistamine undergoes an oxidative deamination catalyzed by monoamine oxidase B (MAO-B), as is common with other monoaminergic neurotransmitters and neuromodulators of the central nervous system. The fact that histamine requires such a conversion prior to oxidative deamination is intriguing since MAO-B is known to be relatively promiscuous towards monoaminergic substrates; its in-vitro oxidation of N-methylhistamine is about 10 times faster than that for histamine, yet this rather subtle difference appears to be governing the decomposition pathway. This work clarifies the MAO-B selectivity toward histamine and N-methylhistamine by multiscale simulations of the rate-limiting hydride abstraction step for both compounds in the gas phase, in aqueous solution, and in the enzyme, using the established empirical valence bond methodology, assisted by gas-phase density functional theory (DFT) calculations. The computed barriers are in very good agreement with experimental kinetic data, especially for relative trends among systems, thereby reproducing the observed MAO-B selectivity. Simulations clearly demonstrate that solvation effects govern the reactivity, both in aqueous solution as well as in the enzyme although with an opposing effect on the free energy barrier. In the aqueous solution, the transition-state structure involving histamine is better solvated than its methylated analog, leading to a lower barrier for histamine oxidation. In the enzyme, the higher hydrophobicity of N-methylhistamine results in a decreased number of water molecules at the active side, leading to decreased dielectric shielding of the preorganized catalytic electrostatic environment provided by the enzyme. This renders the catalytic environment more efficient for N-methylhistamine, giving rise to a lower barrier relative to histamine. In addition, the transition state involving N-methylhistamine appears to be stabilized by the surrounding nonpolar residues to a larger extent than with unsubstituted histamine, contributing to a lower barrier with the former.     

Studies on the oxygen uptake of fat emulsions used in intravenous alimentation

The rate of oxidation of various emulsions designed for intravenous use was studied manometrically. Soybean phosphatide dispersions rapidly absorbed oxygen at 38°C. whereas when used in emulsions containing fat with or without additional stabilizing agents, little oxygen was absorbed even when such unsaturated oils as linseed were used. On the other hand, emulsions of oils stabilized with gelatin took up oxygen rapidly, and the finer the size of the fat particles, the more rapidly was oxygen taken up. At 60°C. all rates of oxidation were increased, but the differences between preparations remained. The results are discussed.     

DVB-H: Digital Broadcast Services to Handheld Devices

This paper gives a brief review of the new Digital Video Broadcasting-Handheld(DVB-H) standard. This is based on the earlier standard DVB-T, which is used for terrestrial digital TV broadcasting. The new extension brings features that make it possible to receive digital video broadcast type services in handheld, mobile terminals. The paper discusses the key technology elements-4K mode and in-depth interleavers, time slicing and additional forward error correction-in some detail. It also gives extensive range of performance results based on laboratory measurements and real field tests. Finally it presents viewpoints relevant for DVB-H network design and system use in general.     

Improvement of ammonia removal in activated sludge process with feedforward-feedback aeration controllers.

In the paper three linear aeration controllers that can be easily implemented are presented and evaluated on the activated sludge process pilot plant. Controllers differ according to the information that is used about the process, which can be oxygen in the last aerobic reactor, ammonia in the last aerobic reactor and ammonia in the influent. The aeration controllers that are addressed are: oxygen cascade PI controller, ammonia cascade PI controller and ammonia feedforward-cascade PI controller. Experiments show that, in comparison with the oxygen cascade PI controller, the ammonia cascade PI controller allows better control of effluent ammonia and airflow savings of around 23%, while the ammonia feedforward-cascade PI controller gives the best reduction of ammonia peaks and can save up to 45% of the airflow.     

BJ: an S-Plus program to fit linear regression models to censored data using the Buckley-James method

Most researchers are familiar with ordinary multiple regression models, most commonly fitted using the method of least squares. The method of Buckley and James (J. Buckley, I. James, Linear regression with censored data, Biometrika 66 (1979) 429-436.) is an extension of least squares for fitting multiple regression models when the response variable is right-censored as in the analysis of survival time data. The Buckley-James method has been shown to have good statistical properties under usual regularity conditions (T.L. Lai, Z. Ying, Large sample theory of a modified Buckley-James estimator for regression analysis with censored data, Ann. Stat. 19 (1991) 1370-1402.). Nevertheless, even after 20 years of its existence, it is almost never used in practice. We believe that this is mainly due to lack of software and we describe here an S-Plus program that through its inclusion in a public domain function library fully exploits the power of the S-Plus programming environment. This environment provides multiple facilities for model specification, diagnostics, statistical inference, and graphical depiction of the model fit.     

Comparison of control strategies for nitrogen removal in an activated sludge process in terms of operating costs: a simulation study

In this paper several control strategies for nitrogen removal are proposed and evaluated in a benchmark simulation model of an activated sludge process. The goal is to determine which control strategy delivers better performance with respect to plant operating costs. In the study, constant manipulated variables and various PI and feedforward control strategies are tested and compared with predictive control, which uses an ideal process model. The control strategies differ in the information used about the process (number of sensors and sensor location) and in the complexity of the control algorithms. To determine the set-points that yield optimal operating costs, an operational map is constructed for each control strategy. Results of the simulation show that with PI and feedforward controllers almost the same optimal operating costs can be achieved as with more advanced MPC algorithms under various plant operating conditions. More advanced control algorithms are advantageous only in cases where the plant is highly loaded and if stringent effluent fines are imposed by legislation.