Quantitative structure—activity relationships of light-dependent herbicidal 4-pyridone-3-carboxanilide derivatives II. Substituent effects of anilide and pyridone moieties

The variations in the light-dependent herbicidal activity against Echinochloa oryzicola of a number of 4-pyridone-3-carboxanilides with various substituents on the anilide and pyridone rings have been examined by use of physicochemical substituent parameters and regression analysis. The effects of substituents of the anilide ring were such that the activity was related parabolically not only with the substituent hydrophobicity (π) but also with the steric bulk parameter (E_s) of the bulkier ortho substituent. The effect of substituents at the 1-position of the pyridone ring was analysed with steric(STERIMOL L and B₅) and electronic(γ₁) parameters. That of substituents at the 5-position of the pyridone ring was explained by a parabolic function of a steric (MR) parameter. Analyses of the activity of 105 analogs confirmed that our previous selection of a candidate compound in this series for field trials was indeed appropriate in terms of physicochemical substituent effects.     

多孔介质两相流的统一毛细压力--饱和度关系曲线

有机污染物(NAPLs)在地下水非饱和区和饱和区中的运动属于多孔介质中的多相流问题,其中毛细压力与饱和度的关系是求解多相流运动方程的基础. 前人的研究表明,对于一定的多孔介质,建立其中任意两相流的统一毛细压力饱和度关系曲线是可能的.利用多孔介质毛细管模型,得到了利用气水两相的毛细压力饱和度关系式推求气-NAPL、水-NAPL两相的毛细压力饱和度关系的毛细压力折算系数.从而得出对于同一介质中的任意两相流动,只要某两相的毛细压力饱和度关系(一般选择气水两相)已知,其它任意两相的关系都可以通过所得出的毛细压力折算系数而得到.     

Quantitative structure—activity relationships of light-dependent herbicidal 4-pyridone-3-carboxanilides I. Effect of benzene ring substituents at the anilide moiety

A number of substituted 4-pyridone-3-carboxanilide derivatives show various degrees of light-dependent herbicidal activity. The effects of substituents at the anilide moiety on the activity against Echinochloa oryzicola were analysed quantitatively with physicochemical substituent parameters. The activity was shown to vary parabolically with total hydrophobicity (Σπ) of the anilide ring substituents as well as with the steric parameter (E_s) of the ortho-substituents. The E_s parameter for only the bulkier ortho-substituent, with the more negative value, but not for the two, was significant. The effect of substituents at the 1-position was expressible by indicator variables assigned to each 1-substituted series, the physicochemical rationalization being left for future analyses.     

Quantitative structure-activity relationships of light-dependent herbicidal 4-pyridone-3-carboxanilides III. 3-D (comparative molecular field) analysis including light-dependent diphenyl ether herbicides

Using a set of representative members selected from 4-pyridone-3-carboxanilides and ortho-chlorinated diphenyl ethers exhibiting light-dependent herbicidal activity, we examined the three-dimensional structure-activity relationships quantitatively. The most stable conformation of each compound, regarded as the ‘active conformation’, was determined by either semi-empirical or ab initio molecular orbital calculations. With a hypothesis defining a common substructural skeleton between the two different compound series. each molecule was superimposed. We first analysed the structure-activity relationship using an index for the substructure shape similarity according to the superimposed conformations. After finding the relevance of the hypothesis, we examined the three-dimensional structure-activity relationship using the comparative molecular field analysis procedure. The results suggested that the two different series of compounds have a common region of the receptor site. The variations in the light-dependent herbicidal potency were governed by hydrophobicty and three-dimensional steric and electronic field parameters of molecules participating in the transport process and the interaction with the receptor site. The result was consistent with that derived from our previous quantitative analysis with the use of free-energy-related substituent parameters and the traditional regression procedure for a large number of pyridone-carboxanilides.     

Anthracnose of Japanese radish caused by Colletotrichum dematium

Anthracnose of Japanese radish found in Kagoshima and Miyazaki prefectures was demonstrated to be caused by Colletotrichum dematium based on inoculation experiments and morphological and molecular identification of the pathogenic fungus. Although symptoms of Japanese radish anthracnose caused by Colletotrichum higginsianum were similar to those caused by C. dematium, damage by the latter pathogen was more severe than that by C. higginsianum.     

Analysis of deflection and dynamic plant characteristics of Cyperus malaccensis Lam

ABSTRACT

In this study, flexural rigidity, natural frequency, and damping coefficient of Cyperus malaccensis Lam. with long stems were measured for application for fluid–structure interaction simulation in a field. Numerical solutions of deflection and natural frequency were calculated by ANSYS with finite element method (FEM). The triangular cross-section shape of C. malaccensis stem has a big neighbourhood of the root and the cross-section has taper structure to become small towards tip direction. Two numerical simulation models for FEM have Model A with a triangular prism shape and Model B with a truncated trigonal pyramidal shape to evaluate the effects of stem tapering. Because of large C. malaccensis stem deflection, an equation for nonlinear deflection was introduced to solve a problem regarding flexural rigidity. Natural frequencies of the stem were estimated using amplitude ratio during stem swinging by forced vibration, captured using a high-speed camera. The Model B corresponded with the measurement, and the results suggested that the stem characteristics were affected by cross-section shape. Damping coefficient was calculated using free vibration response, which was consistent with the analytical solution and numerical data calculated using measured characteristics.