Evaluation of Antiproliferative Palladium(II) Complexes of Synthetic Bisdemethoxycurcumin towards In Vitro Cytotoxicity and Molecular Docking on DNA Sequence

Metallodrugs form a large family of therapeutic agents against cancer, among which is cisplatin, a paradigmatic member. Therapeutic resistance and undesired side effects to Pt(II) related drugs, prompts research on different metal–ligand combinations with potentially enhanced biological activity. We present the synthesis and biological tests of novel palladium(II) complexes containing bisdemethoxycurcumin (BDMC) 1 and 2. Complexes were fully characterized and their structures were determined by X-ray diffraction. Their biological activity was assessed for several selected human tumor cell lines: Jurkat (human leukaemic T-cell lymphoma), HCT-116 (human colorectal carcinoma), HeLa (human cervix epitheloid carcinoma), MCF-7 (human breast adenocarcinoma), MDA-MB-231 (human mammary gland adenocarcinoma), A549 (human alveolar adenocarcinoma), Caco-2 (human colorectal carcinoma), and for non-cancerous 3T3 cells (murine fibroblasts). The cytotoxicity of 1 is comparable to that of cisplatin, and superior to that of 2 in all cell lines. It is a correlation between IC₅₀ values of 1 and 2 in the eight studied cell types, promising a potential use as anti-proliferative drugs. Moreover, for Jurkat cell line, complexes 1 and 2, show an enhanced activity. DFT and docking calculations on the NF-κB protein, Human Serum Albumin (HSA), and DNA were performed for 1 and 2 to correlate with their biological activities.     

Behavioural breaks in the heterogeneous agent model: The impact of herding,overconfidence, and market sentiment

The main aim of this work is to incorporate selected findings from behavioural finance into a Heterogeneous Agent Model using the Brock and Hommes (1998) [34] framework. Behavioural patterns are injected into an asset pricing framework through the so-called ‘Break Point Date’, which allows us to examine their direct impact. In particular, we analyse the dynamics of the model around the behavioural break. Price behaviour of 30 Dow Jones Industrial Average constituents covering five particularly turbulent US stock market periods reveals interesting patterns in this aspect. To replicate it, we apply numerical analysis using the Heterogeneous Agent Model extended with the selected findings from behavioural finance: herding, overconfidence, and market sentiment. We show that these behavioural breaks can be well modelled via the Heterogeneous Agent Model framework and they extend the original model considerably. Various modifications lead to significantly different results and model with behavioural breaks is also able to partially replicate price behaviour found in the data during turbulent stock market periods.     

Order-from-disorder effect in the exactly solved mixed spin-(1/2, 1) Ising model on fully frustrated triangles-in-triangles lattices

The mixed spin-(1/2, 1) Ising model on two fully frustrated triangles-in-triangles lattices is exactly solved with the help of the generalized star-triangle transformation, which establishes a rigorous mapping correspondence with the equivalent spin- 1/2 Ising model on a triangular lattice. It is shown that the mutual interplay between the spin frustration and single-ion anisotropy gives rise to various spontaneously ordered and disordered ground states, which differ mainly in an occurrence probability of the non-magnetic spin state of the integer-valued decorating spins. We have convincingly evidenced a possible coexistence of the spontaneous long-range order with a partial disorder within the striking ordered–disordered ground state, which manifests itself through a non-trivial criticality at finite temperatures as well. A rather rich critical behavior including the order-from-disorder effect and reentrant phase transitions with either two or three successive critical points is also found.     

Switching mechanism in polar columnar mesophases made of bent-core molecules.

The behaviour of polar, broken-layer-type columnar phases made of bent molecules (B(1Rev) and B(1RevTilted)) was studied under an applied electric field. There are two competing mechanisms of ferroelectric switching in the polar B(1RevTilted) columnar phase: collective rotation around the long molecular axis and collective rotation around the tilt cone. The proposed model shows that the main factor discriminating the type of switching is the width of the column cross-section.     

Solution of solute transport in unsaturated porous media by the method of characteristics

A degenerate convection‐diffusion problem is approximated using the scheme that is based on the relaxation method and also the method of characteristics. A mathematical model for solute transport in unsaturated porous media is included. Moreover, multiple site adsorption is considered. Convergence of the scheme is proved and numerical experiments in 1D and 2D are presented. © 2003 Wiley Periodicals, Inc. Numer Methods Partial Differential Eq 19: 732–761, 2003.     

Co-based Soft Magnetic Bulk Materials Prepared by Hot Powder Compaction

Low-coercive bulk amorphous compacts with relative density 99 were prepared by compaction of ball milled Co₅₆Fe₁₆Zr₈B₂₀ ribbons in the supercooled-liquid state. Further, addition of nanocrystalline Fe_72.5Cu₁Nb₂Mo₂Si_15.5B₇ powder to the Co₅₆Fe₁₆Zr₈B₂₀ powder causes a decrease of the magnetostriction of the resultant bulk samples.     

Synthesis and polymerization reactions of cyclic imino ethers. VI. Polymers with biphenyl structure

A monomer of the AB‐type and a bifunctional comonomer of the AA‐type containing two 2‐oxazoline rings and a biphenyl structural unit were prepared from the corresponding carboxylic acids via their esterification and subsequent amidation with an aminoalcohol. The cyclization of an amide to 2‐oxazoline structure was achieved by treatment with thionyl chloride followed by liberation of the free base with sodium hydrocarbonate in an aqueous solution. The prepared monomers were used for the polyaddition polymerization of the AB‐type monomer having a 2‐oxazoline and phenol group bound on adjacent rings of the biphenyl structure in solution. The monomer of the AA‐type was used for AA+BB‐type polyaddition reactions with aliphatic dicarboxylic acids. Both types of polymerizations have been performed in melt and in solution. The structures of the polymers were determined, and the thermal properties of the polymers were evaluated. Liquid‐crystalline (LC) structures of the prepared polymers were observed by DSC measurements and optical microscopy. The polyaddition reactions of the monomers containing a 2‐oxazoline ring and a biphenyl unit represent a new efficient way for the preparation of a biphenyl unit containing poly(ether amide)s and poly(ester amide)s. © 2012 Wiley Periodicals, Inc. J Polym Sci Part A: Polym Chem, 2012     

Calorific value and fire risk of selected fast-growing wood species

This study deals with heat of combustion of selected fast-growing woods. The study also investigates the impact of heat flux on fire risk of the selected fast-growing woods. The hybrid poplar J-105 (Populus nigra × P. maximowiczii), white willow (Salix alba L.) and black locust (Robinia pseudoacacia L.) woods were measured. The heats of combustion were determined by a bomb calorimeter. Fire risk was evaluated with a cone calorimeter at different heat fluxes. The net heat of combustion occurred in the interval from 17.68 MJ kg^?1 (black locust) to 18.02 MJ kg^?1 (hybrid poplar). Fire risk was assessed on the basis of the critical heat flux, maximum average rate of heat emission, carbon monoxide yield, smoke yield and time to flashover. The hybrid poplar had the lowest critical heat flux (12.8 kW m^?2), and the white willow had the highest critical heat flux (17.4 kW m^?2). The maximum average rate of heat emission and the smoke yield increased with the increasing heat flux. On the other hand, carbon monoxide yield decreased with the increasing heat flux. The differences between the times to flashover of the measured wood species were not significant.