scholarly journals MATHEMATICAL MODELING OF THE 3(Н)-QUINAZOLIN-4-ONЕ SYNTHESIS PROCESS

2021 ◽  
pp. 51-57

The aim is to optimize the conditions for the synthesis of 3(H)-quinazolin-4-one by the method of mathematical modeling to develop a technology for producing the substance of a new domestic drug used in the treatment of farm animals from helminths. In mathematical modeling, the method of a small number of squares was used. Analytical dependences of the product yield on temperature, reaction time, and molar ratios of the starting materials were determined. A system of linear equations has been compiled. The system of linear equations was performed by the matrix method (A, B, C).The average reaction rate was determined. Based on the results obtained, a 3(H)-quinazolin-4-one diagram using the Maple 18 program and an icon diagram of the reaction duration, temperature, and reaction rate are shown. Based on the results of mathematical modeling, a highly efficient technological scheme for obtaining 3(H)-quinazolin-4-one has been developed. Based on this technology, compound 3(H)-quinazolin-4-one was synthesized in quantitative products at the Institute of Plant Chemistry, at a pilot production plant.The results obtained confirmed the found optimal conditions

1995 ◽  
Vol 38 (3) ◽  
pp. 495-510 ◽  
Author(s):  
C. Brezinski ◽  
A. Salam

Sequence transformations are extrapolation methods. They are used for the purpose of convergence acceleration. In the scalar case, such algorithms can be obtained by two different approaches which are equivalent. The first one is an elimination approach based on the solution of a system of linear equations and it makes use of determinants. The second approach is based on the notion of annihilation difference operators. In this paper, these two approaches are generalized to the matrix and the vector cases.


Author(s):  
Jack-Kang Chan

We show that the well-known least squares (LS) solution of an overdetermined system of linear equations is a convex combination of all the non-trivial solutions weighed by the squares of the corresponding denominator determinants of the Cramer's rule. This Least Squares Decomposition (LSD) gives an alternate statistical interpretation of least squares, as well as another geometric meaning. Furthermore, when the singular values of the matrix of the overdetermined system are not small, the LSD may be able to provide flexible solutions. As an illustration, we apply the LSD to interpret the LS-solution in the problem of source localization.


2020 ◽  
Vol 20 (4) ◽  
pp. 845-854
Author(s):  
SUAYIP YUZBASI ◽  
NURCAN BAYKUS SAVASANERIL

In this study, a collocation approach based on the Hermite polyomials is applied to solve the singularly perturbated delay differential eqautions by boundary conditions. By means of the matix relations of the Hermite polynomials and the derivatives of them, main problem is reduced to a matrix equation. And then, collocation points are placed in equation of the matrix. Hence, the singular perturbed problem is transformed into an algebraic system of linear equations. This system is solved and thus the coefficients of the assumed approximate solution are determined. Numerical applications are made for various values of N.


Author(s):  
Quan Quan Tan ◽  
Thomas Peyrin

In this article, we propose new heuristics for minimising the amount of XOR gates required to compute a system of linear equations in GF(2). We first revisit the well known Boyar-Peralta strategy and argue that a proper randomisation process during the selection phases can lead to great improvements. We then propose new selection criteria and explain their rationale. Our new methods outperform state-of-the-art algorithms such as Paar or Boyar-Peralta (or open synthesis tools such as Yosys) when tested on random matrices with various densities. They can be applied to matrices of reasonable sizes (up to about 32 × 32). Notably, we provide a new implementation record for the matrix underlying the MixColumns function of the AES block cipher, requiring only 94 XORs.


2019 ◽  
Vol 16 (3) ◽  
pp. 398-404 ◽  
Author(s):  
Yang Zou ◽  
Jingyi Fei ◽  
Liangzhe Chen ◽  
Qingfeng Dong ◽  
Houbin Li

Background: 3,3,7,7-tetrakis (difluoramino) octahydro-1,5-dinitro-1,5-diazocine (HNFX), as an important oxidizer in propellants, has received much attention due to its high density and energy. However, there are many difficulties that need to be solved, such as complex synthetic processes, low product yield, high cost of raw materials and complicated purification. In the synthesis of HNFX, the intermediate named 1,5-bis (p-toluenesulfonyl)-3,7-dihydroxyoctahydro-1, 5-diazocine (gem-diol), is difficult to synthesize. Methods: A simple method was used to synthesize the gem-diol. This prepared gem-diol was characterized by FT-IR, 1H NMR, melting point and mass spectrometry. In order to increase the yield of gem-diol, response surface methodology (RSM) was introduced to optimize experimental conditions. Results: After the establishment of the model, the optimal conditions of synthesis were found to be 9.33h for reaction time, 6.13wt. % for the concentration of NaOH and 1.38:1 for ratio of ECH (p-toluenesulfonamide): TCA (epichlorohydrin). Under the optimal conditions, the experimental value and the predicted value of yield were 22.18% and 22.92%, respectively. Conclusion: 1,5-bis (p-toluenesulfonyl)-3,7-dihydroxyoctahydro-1,5-diazocine (gem-diol) can be synthesized using the low cost of chemical materials, including p-toluenesulfonamide, epichlorohydrin, sodium hydroxide and ethanol. Response surface methodology (RSM) is an effective method to optimize the synthesis process, thereby improving the yield of gem-diol.


2019 ◽  
Vol 09 (4) ◽  
pp. 32-45 ◽  
Author(s):  
A.V. Panteleev ◽  
V.S. Saveleva

The article discusses the study of a mathematical model of execution of the production task in the presence of fuzzy information about the matrixes of direct costs and final demand. By solving a problem with fuzzy information we mean the solution of a linear system of equations with a fuzzy matrix and a fuzzy right-hand side described by fuzzy triangular numbers in a form of deviations from the mean. In this task of search of inter-sectoral balance the LU-decomposition method for the matrix of direct cost which is further used for solving the system of linear equations is applied. A software implementation of a numerical method for finding a strong solution of a fuzzy system of linear equations consisting of two successive stages is described. At the first stage, the necessary and sufficient conditions for the existence of a strong solution are verified. At the second stage, the solution of the system is found, which is written in the form of a fuzzy matrix. The influence of the fuzzy numbers parameters on the final result was studied.


2018 ◽  
Vol 877 ◽  
pp. 54-59 ◽  
Author(s):  
R.C. Mohan Kumar ◽  
C. Velmurugan

The blanking operation have several die design parameters which affect the quality of the blank and its productivity. The main input parameters are sheet thickness and the punch and die clearance and the dependent output parameters are tool life and the burr height. The selected values should be in optimal value. The optimum value is achieved by using the genetic algorithm. The genetic algorithm is an optimization process to find the better results as an output. Then the development of mathematical modeling by using the equations derived from the multiple regression analysis is performed. It is achieved by converting the linear equations into the matrix form and then solving it using mathematical relations. This output is compared with the genetic algorithm results, to get the better results.


2020 ◽  
Vol 12 (2) ◽  
pp. 368-375
Author(s):  
N.B. Ladzoryshyn ◽  
V.M. Petrychkovych ◽  
H.V. Zelisko

The method for solving the matrix Diophantine equations over quadratic rings is developed. On the basic of the standard form of matrices over quadratic rings with respect to $(z,k)$-equivalence previously established by the authors, the matrix Diophantine equation is reduced to equivalent matrix equation of same type with triangle coefficients. Solving this matrix equation is reduced to solving a system of linear equations that contains linear Diophantine equations with two variables, their solution methods are well-known. The structure of solutions of matrix equations is also investigated. In particular, solutions with bounded Euclidean norms are established. It is shown that there exists a finite number of such solutions of matrix equations over Euclidean imaginary quadratic rings. An effective method of constructing of such solutions is suggested.


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