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Supercomputer and Chemistry: IABG Workshop 1989

Editat de Uwe Harms
en Limba Engleză Paperback – 27 sep 1990

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Specificații

ISBN-13: 9783540529156
ISBN-10: 3540529152
Pagini: 152
Ilustrații: VII, 143 p. 4 illus.
Dimensiuni: 170 x 242 x 8 mm
Greutate: 0.25 kg
Ediția:Softcover reprint of the original 1st ed. 1990
Editura: Springer Berlin, Heidelberg
Colecția Springer
Locul publicării:Berlin, Heidelberg, Germany

Public țintă

Research

Cuprins

Supercomputers — The Situation Today.- Graphic Supercomputing on the Ardent and Stellar Graphics Supercomputers.- Transputer — A General Survey.- Transputers in Technical Applications.- Quantum Chemical Calculations on MIMD Type Computers.- Parallelizing an SCF Program on SUPRENUM.- Drug Design: A Combination of Experiment and Computational Chemistry.- Conformational Analysis of Peptides Using Molecular Dynamics.- The Use of Supercomputers in Medicinal Chemistry Examples from Peptide and Protein Projects.- Local Density Functional Calculations on Properties of Large Molecules.- Density Functional Calculations with Simulated Annealing — New Perspectives for Molecular Calculations.- Authors’ Index.