Results 191 to 200 of about 574,284 (242)
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Computer programs for calculating equivalent conductivity and dissociation constants
Journal of Chemical Education, 1970Lists several computer programs available for calculating equivalent conductivity and dissociation constants.
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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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Journal of inclusion phenomena and molecular recognition in chemistry, 1997
A computer program is presented for the computation of association constants for host/guest compounds based on experimental data obtained from the NMR spectra of samples with different host/guest ratios of known concentration.
Dolors Salvatierra +2 more
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A computer program is presented for the computation of association constants for host/guest compounds based on experimental data obtained from the NMR spectra of samples with different host/guest ratios of known concentration.
Dolors Salvatierra +2 more
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POLAG—a general computer program to calculate stability constants from polarographic data
Talanta, 1980A general computer program, POLAG, that will calculate stability constants from polarographic data, has been written. The program requires no pretreatment of the experimental data. Any equilibrium model, consisting of species having the general formula M(m)H(j)(OH)(k)L(n)L'(p) may be fitted to the data. The performance and versatility of POLAG has been
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Journal of the Chemical Society, Dalton Transactions, 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.
Peter Gans +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.
Peter Gans +2 more
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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.
A, Faure +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.
A, Faure +3 more
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Talanta, 1985
The program MINIPOL, designed to run on a desk-computer with 32 kbytes of memory, can calculate the optimum values of overall protonation constants and molar intensities of up to 8 species with composition H(XXX)L(rho), from differential-pulse polarographic data.
V, Cerdá, R, Forteza
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The program MINIPOL, designed to run on a desk-computer with 32 kbytes of memory, can calculate the optimum values of overall protonation constants and molar intensities of up to 8 species with composition H(XXX)L(rho), from differential-pulse polarographic data.
V, Cerdá, R, Forteza
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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
Per Jönsson +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
Per Jönsson +2 more
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An improved computer program for calculating formation constants of ligand complexes from pH data
Analytica Chimica Acta, 1984Abstract Several improvements are made to available computer programs for calculating formation constants from pH data. The most important features are wide portability of program among computers, ability to optimize any parameter in the model equations and to fix any parameters (including stepwise formation constants) to a constant, and options to ...
John P. Chandler +3 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 ...
V. Gadjokov, H. Mihailova
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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 ...
V. Gadjokov, H. Mihailova
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