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Publication search results
found 45 matches
- 1985
- Rafael Andreu, Juan A. Cejudo, Enrique Sánchez Marcos:
IONPIT: A full implementation of Pitzer's ion interaction treatment. Comput. Chem. 9(3): 185-190 (1985) - Krishnan Balasubramanian:
Computer-assisted enumeration of walks and self-returning walks on chemical graphs. Comput. Chem. 9(1): 43-52 (1985) - J. G. Balz, R. A. Bernheim, L. P. Gold, T. Linn:
Unlimited data acquisition at moderately high sampling frequencies with a microcomputer. Comput. Chem. 9(1): 53-55 (1985) - Ross C. Beier:
A calculator program for computing quantities of solvents required when changing percentages in solvent systems. Comput. Chem. 9(1): 57-60 (1985) - F. J. Bermejo, M. Rico, Tapani Ryhänen, E. Martìnez, J. Garcìa, J. Santoro:
Moltw: A program for conformational studies using empirical functions - I. Description and general evaluation. Comput. Chem. 9(3): 195-201 (1985) - J. D. Bossaerts, G. L. Lemiére, F. C. Alderweireldt:
Determination of the first order reaction rate constant by weighted linear regression. Comput. Chem. 9(3): 203-207 (1985) - Foo-Tim Chau:
An iterative method for Franck-Condon factor calculations with the use of the morse potential function to estimate equilibrium bond lengths of diatom. Comput. Chem. 9(1): 19-22 (1985) - J. Ciosowski, A. M. Turek:
An Algorithm to generate the compact name of benzenoid hydrocarbons. Comput. Chem. 9(4): 247-257 (1985) - David D. Clark, Sheldon M. Schuster:
A small laboratory data system. Comput. Chem. 9(2): 85-97 (1985) - Michael L. Connolly, Arthur J. Olson:
GRANNY, a companion to GRAMPS for the real-time manipulation of macromolecular models. Comput. Chem. 9(1): 1-6 (1985) - E. KatzCarl W. David:
Assembling coordinates of individual helices into collagen-like aggregates. Comput. Chem. 9(3): 183-184 (1985) - DeLos F. DeTar:
Interactive FORTRAN 77, a hands-on approach : Edited by I. D. Chivers and M. W. Clark, Ellis Horwood Limited. Comput. Chem. 9(1): 77 (1985) - DeLos F. DeTar:
Methods in computational molecular physics : Edited by G. H. F. Diercksen and S. Wilson, D. Reidel Publishing Company, Dordrecht, Holland, 1983. Comput. Chem. 9(1): 78 (1985) - DeLos F. DeTar:
Pascal for FORTRAN programmers: By Robert Weiss and Charles Seiter, Addison-Wesley. Comput. Chem. 9(4): 325 (1985) - DeLos F. DeTar:
Computer education of chemists: Edited by Peter Lykos, John Wiley & Sons. Comput. Chem. 9(4): 325 (1985) - DeLos F. DeTar:
Logical and combinatorial algorithms for drug design: By V. E. Golender and A. B. Rozenblit, Research Studies Press Ltd. ISBN 0-471-90266-7, Letchworth, Hertfordshire, England 1983. Comput. Chem. 9(4): 325 (1985) - Gyula Dömötör, M. I. Bán:
Program for assigning molecular orbitals to irreducible representations of symmetry groups. Comput. Chem. 9(3): 179-182 (1985) - John F. Federici, W. Phillip Helman, Gordon L. Hug, C. Kane, L. K. Patterson:
A work station for laboratory data acquisition: flourescence lifetime apparatus. Comput. Chem. 9(3): 171-177 (1985) - T. N. Gallaher, Frank A. Palocsay, J. S. Phillips:
A microcomputer/hall probe data acquisition system for a magnetic sector mass spectrometer. Comput. Chem. 9(2): 99-107 (1985) - John S. Garavelli, Jack E. Leonard:
Improvements in the computer enumeration of permutation isomers. Comput. Chem. 9(2): 133-147 (1985) - Kevin E. Gilbert, Joseph J. Gajewski:
Numerical methods: An implementation of difsub on an ibm-pc. Comput. Chem. 9(3): 191-194 (1985) - Robin A. Gordon, Andreas Müller:
An algorithm for determining possible empirical formulae of chemical compounds. Comput. Chem. 9(1): 27-38 (1985) - Micheline Grignon-Dubois, Michel Laguerre:
Programme de simulation de spectres RMN 29Si Obtenus par inversion selective de population. Comput. Chem. 9(4): 279-284 (1985) - Yoshiyuki Hase:
Evaluation of one-center coulomb integrals involving s-functions by a programmable calculator. Comput. Chem. 9(4): 285-287 (1985) - Harry G. Hecht:
Calculation of the crystal field hamiltonian for an arbitrary distribution of ligands. Comput. Chem. 9(4): 295-299 (1985) - Joseph W. Hovanec, J. Richard Ward:
Nonlinear least-squares fitting of first-order rate coefficients (comparison between the Gauss-Seidel method and Swain's KORE program). Comput. Chem. 9(1): 23-25 (1985) - D. Jutras, W. I. Patterson, M. Perrier, C. Chavarie:
Programmable calculator section Solving simultaneous ordinary first-order differential equations using a programmable calculator. Comput. Chem. 9(2): 149-154 (1985) - Loraine Watt, James Kao:
Chemical Draftsman (CDRAFT). Comput. Chem. 9(4): 269-277 (1985) - J. R. Kingsley, Richard L. Hilderbrandt:
An algorithm for entering mathematical functions as input to a fortran program. Comput. Chem. 9(4): 289-293 (1985) - Edward C. Kirby:
The characteristic polynomial: Evaluation as a function of X and as a function of the characteristic polynomials of a linear polyenes using a small com. Comput. Chem. 9(2): 79-83 (1985)
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