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http://worldcat.org/entity/work/id/796575347

Supercomputer and chemistry 2 debis workshop 1990, Ottobrunn, November 19-20, 1990

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  • "Ottobrunn, November 19-20, 1990"
  • "Supercomputer and chemistry two"@en
  • "Supercomputer and chemistry two"

contributor

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description

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  • "Supercomputing and networking are of great importance in the field of computer chemistry. In this volume some fundamen- tals are discussed; new results are presented in the paral- lelization of a direct SCF on workstations and of several application programs, in the long time dynamics of proteins and for the IGLO method. A general overview of quantum che- mical calculations of small molecules is included. That com- putational methods complement experimental approaches, is demonstrated with short-lived intermediates (carbocations, alkyl radicals) and the 3-D-structure of saruplase-domains."

editor

genre

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  • "Electronic books"
  • "Conference papers and proceedings"@en
  • "Conference papers and proceedings"

name

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  • "Supercomputer and chemistry 2 : Debis Workshop 1990, Ottobrunn, November 19 - 20, 1990; with 21 tables"
  • "Supercomputer and chemistry 2 debis workshop 1990, Ottobrunn, November 19-20, 1990"@en
  • "Supercomputer and chemistry 2 : debis workshop 1990, Ottobrunn, November 19-20, 1990"
  • "Supercomputer and chemistry 2 : debis workshop 1990, Ottobrunn, November 19-20, 1990"@en
  • "Supercomputer and Chemistry 2 : DEBIS Workshop 1990 : Ottobrunn, November 19-20, 1990"
  • "Supercomputer and chemistry 2 : debis workshop 1990, [2. meeting]"
  • "Supercomputer and Chemistry 2 debis Workshop 1990 Ottobrunn, November 19-20, 1990"

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