Results 241 to 250 of about 558,879 (285)
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A computer program to support equilibrium constant theory
Journal of Chemical Education, 1975A Fortran IV program calculates ten different K values based on different equilibrium expressions that are chosen at random.
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Computer Programs in Biomedicine, 1980
We propose a method allowing the automatic determination of equilibrium constants and binding site concentrations for an immune serum composed of a series of homogeneous antibody subpopulations. It is then possible to decompose the 'Scatchard plot' in its straight components corresponding to each antibody subpopulation.
C. Nemoz +3 more
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We propose a method allowing the automatic determination of equilibrium constants and binding site concentrations for an immune serum composed of a series of homogeneous antibody subpopulations. It is then possible to decompose the 'Scatchard plot' in its straight components corresponding to each antibody subpopulation.
C. Nemoz +3 more
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Eyringpy: A program for computing rate constants in the gas phase and in solution
International Journal of Quantum Chemistry, 2018AbstractEyringpy is a modular program for calculating thermochemical properties and rate constants for reactions in the gas phase and in solution. The code is written in Python and it has a user‐friendly interface and a simple input format. Unimolecular and bimolecular reactions with one and two products are supported.
Eugenia Dzib +5 more
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Chemischer Informationsdienst, 1985
A new computer program has been developed in which formation constants are determined by minimisation of an error-square sum based on measured electrode potentials. The program also permits refinement of any reactant concentration or standard electrode potential. The refinement is incorporated into a new procedure which can be used for model selection.
Alberto Vacca +2 more
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A new computer program has been developed in which formation constants are determined by minimisation of an error-square sum based on measured electrode potentials. The program also permits refinement of any reactant concentration or standard electrode potential. The refinement is incorporated into a new procedure which can be used for model selection.
Alberto Vacca +2 more
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International Journal of Bio-Medical Computing, 1979
The paper describes a non-linear multiple regression program to analyse data arising from the binding of a single ligand by a protein under the assumption that the reaction can be represented by the exponential model for a regulatory enzyme.
Julian Kinderlerer, Stanley Ainsworth
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The paper describes a non-linear multiple regression program to analyse data arising from the binding of a single ligand by a protein under the assumption that the reaction can be represented by the exponential model for a regulatory enzyme.
Julian Kinderlerer, Stanley Ainsworth
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Inorganica Chimica Acta, 1983
Abstract We have developed, separately and together, a sequence of computer programs for the determination of stability constants from potentiometric titration data: LEAST [1], MINIQUAD [2], MINIQUAD75 [3], MINIQUAD76A [4] and MIQUV [5]. The objective of this research is to develop robust, reliable and fast programs which will enable the solution ...
Antonio Sabatini +2 more
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Abstract We have developed, separately and together, a sequence of computer programs for the determination of stability constants from potentiometric titration data: LEAST [1], MINIQUAD [2], MINIQUAD75 [3], MINIQUAD76A [4] and MIQUV [5]. The objective of this research is to develop robust, reliable and fast programs which will enable the solution ...
Antonio Sabatini +2 more
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Computers & Chemistry, 1989
Abstract A regularized iteration-process algorithm for the computation of stability constants from titration data is described. A computer code implementing the method on an APPLE II microcomputer is briefly presented. The results from processing a sample set of real data from the measurements of a cerium-acetate system are discussed as an ...
H. Mihailova, V. Gadjokov
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Abstract A regularized iteration-process algorithm for the computation of stability constants from titration data is described. A computer code implementing the method on an APPLE II microcomputer is briefly presented. The results from processing a sample set of real data from the measurements of a cerium-acetate system are discussed as an ...
H. Mihailova, V. Gadjokov
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A program for computing the Liapunov functions and Liapunov constants in scratchpad II
ACM SIGSAM Bulletin, 1989This report describes the implementation and use of a program for computing the Liapunov functions and Liapunov constants for a class of differential systems in Scratchpad II.
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A computer program to evaluate a counting loss correction constant in XRF analysis
X-Ray Spectrometry, 1981AbstractDifferent sources of counting loss are described and the relation Rt = Rm exp (Rt τ) is considered valid for most commercial XRF counting devices. Based on a series of Kα/Kβ measurements and an initial estimate of the Rt (Kα)/Rt (Kβ) value, corresponding τ values can be computed. If the chosen Rt (Kα)/Rt (Kβ) value differs from the correct one,
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Computer Physics Communications, 1993
Given an electronic wave function, generated by the MCHF program (LS format) or the MCHF_CI program (LSJ format), this program computes the hyperfine interaction constants, A(J) and B(J). In strong experimental magnetic fields, the splitting is also affected by the off-diagonal hyperfine constants A(J,J-1), B(J,J-1), and B(J,J-2) and these are computed
Claes-Göran Wahlström +2 more
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Given an electronic wave function, generated by the MCHF program (LS format) or the MCHF_CI program (LSJ format), this program computes the hyperfine interaction constants, A(J) and B(J). In strong experimental magnetic fields, the splitting is also affected by the off-diagonal hyperfine constants A(J,J-1), B(J,J-1), and B(J,J-2) and these are computed
Claes-Göran Wahlström +2 more
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