The main purpose of the present investigation is the study of therapeutically effect of Zotepine in schizophrenia disease treatment. In first step, the molecular structure of the said compound is optimized using density functional theory (DFT) technique by B3LYP functional method at 6-311++G(d,p) level of theory. Then the electronic properties of the title molecule are calculated using frontier...

This paper is devoted to the study of solvability of an evolution equation obtained as a hydrodynamic limit of a linear Boltzmann equation with inelastic scattering term. An interesting feature of this equation is that it combines the diiusion operator and a singular operator of a kinetic type. The study is carried out in the L 1 space which is natural from physical point of view and allows to ...

A descriptive study of isothermal kinetics of diclofenac release from chitosan-g-acrylic acid (Chit-AA) hydrogel and chitosan-g-(acrylic acid-co-[2-(acryloyloxy)ethyl]trimethylammonium chloride) (Chit-AA-AETM) hydrogel was carried out. Isothermal kinetic curves for diclofenac release from both hydrogels in distilled water at various temperatures of 20-42°C were studie...

A number of experimental and theoretical papers accounted almost exclusively for two channels in the reaction of atomic hydrogen with methanol: H-abstraction from the methyl (R1) and hydroxyl (R2) functional groups. Recently, several astrochemical studies claimed the importance of another channel for this reaction, which is crucial for kinetic simulations related to the abundance of molecular c...