Volume 8,
Number 1,
1983
Volume 8,
Number 2,
1984
- Aivars Celmi:
Analysis of residuals from multidimensional model fitting.
81-89
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- Jaroslaw Kostrowicki, Adam Liwo:
DECFAM - A new computer oriented algorithm for the determination of equilibrium constants from potentionmetric and/or spectrophotometric measurements - I: Basic principles of the method and calculations of equilibrium concentrations.
91-99
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- Jaroslaw Kostrowicki, Adam Liwo:
DECFAM - A new computer oriented algorithm for the determination of equilibrium constants from potentiometric and/or spectrophotometric measurements - II: Methods based on analytical expressions.
101-105
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- Jan V. Knop, Klaus Szymanski, L. Klasinc, Nenad Trinajstic:
Computer enumeration of substituted polyhexes.
107-115
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- Roberto Alfredo Moré:
Using an HP-1000 computer to calculate the conformational energy of molecules by body's algorithm.
117-121
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- J. E. House Jr.:
An algorithm for computing dimerization constants for polar molecules.
123-126
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- Giorgio Castellani, Raimondo Scordamaglia:
A fast computer program for conformational analysis.
127-131
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- R. Dorin:
A computerized electrochemical data acquisition and control system.
133-137
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- R. L. Brown:
Modeling of axially symmetric flow reactors.
139-145
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- Karl Lintner, Serge Fermandjian:
Conformational energy calculation on a microcomputer.
147-150
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- Takashi Okada:
Effective programming for research: Development of software for KINDSIP.
151-155
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- Gerardo Cisneros, Carlos F. Bunge:
An improved computer program for eigenvectors and eigenvalues of large configuration interaction matrices using the algorithm of Davidson.
157-160
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- Paolo Uguagliati, Alvise Benedetti, Stefano Enzo, Liliana Schiffini:
Organometallic chemometrics: I. A minicomputer implementation of abstract factor analysis.
161-168
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- T. G. M. van den Belt, H. Erkelens:
A fast, low cost data acquisition system.
169-173
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- Juan Manuel Madariaga, Adolfo Garcia:
Applications of computers in the study of solution equilibria I LEHENA, a program for polynomial data fitting.
175-185
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- Juan Manuel Madariaga, Adolfo Garcia:
Application of computers in the study of solution equilibria II Complex-80, a program from known ionic equilibria.
187-191
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- Adolfo Garcia, Juan Manuel Madariaga:
Applications of computers in the study of solutions equilibria III Evaluation of some programs for known ionic equilibria.
193-199
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- Ü. Haldna, A. Murshak:
Estimation of the basicity constants of weak bases by the target testing method fo factor anaylysis.
201-204
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- John F. Ogilvie:
A monte-carlo approach to error propagation.
205-207
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- Takahiro Suzuki, Masaru Ishida:
A new hierarchical notation system and its application to the estimation of the standard enthalpy of formation.
209-211
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- C. Mongay, V. Cerdá:
Applications programs : A generalized calculation for preparation of buffer solutions of known ionic strength.
213-216
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- Pierre Cayzergues, Constantin Georgoulis, Gilles Mathieu:
Applications section : Desk top microcomputer evaluation of the rate constants of two competitive parallel second order reactions.
217-223
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- Carl W. David:
Voronoi Polyhedra and cleft recognition in aquated macromolecules.
225-226
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- Michael Ramek:
Comment on "HQRII: A fast diagonaliazation subroutine".
227-230
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- DeLos F. DeTar:
Progress in modelling and simulation: Edited by Francois E. Cellier, Academic Press, London, 1982.
231
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Volume 8,
Number 4,
1984
- Guy-Marie Côme, C. Muller, P. Y. Cunin, M. Griffiths:
A linear chemical notation.
233-237
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- H. Abe, W. Braun, T. Noguti, N. Go:
Rapid calculation of first and second derivatives of conformational energy with respect to dihedral angles for proteins general recurrent equations.
239-247
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- Michael D. Lowery, J. E. House Jr.:
An algorithm for computing the Madelung constant for the sodium chloride lattice.
249-254
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- P. Valko, Sandor Vajda:
An extended ode solver for sensitivity calculations.
255-271
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- Raymond M. Carman:
Calculator programs for NMR ABX analyses.
273-276
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- E. L. Varetti:
Calculation of molecular inertial moments in an infrared data station.
277-280
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- Bhalachandra L. Tembre, James Andrew McCammon:
Ligand-receptor interactions.
281-283
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- W. O. Milligan, D. F. Mullica, D. E. Pennington, C. K. C. Lok, D. W. J. Kwong:
Application of nonlinear least squares analysis on three different consecutive, irreversible first order kinetic processes.
285-298
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- Yoshiyuki Hase:
Evaluation of the Teller-Redlich Product Rule for Non-linear X-Y-Z Molecules by a Programmable Calculator.
299-302
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- Federico Moran, Francisco Montero:
An algorithm to study the evolution and selection of auto replicative molecules.
303-307
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- T. S. Hassan, A. H. El-Dhaher, H. Maarafie, H. Abou Soud, M. S. El-Ezaby:
On-line processing of stopped-flow data for multiple kinetic reactions using a microprocessor-based system.
309-313
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by Michael Ley (ley@uni-trier.de)