MD_Part 2

MD_Part 2 - Control Data Corporation (CDC) 3600 at NCAR...

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University of Virginia, MSE 4270/6270: Introduction to Atomistic Simulations, Leonid Zhigilei Control Data Corporation (CDC) 3600 at NCAR (1963-1969) ¾ “beautiful computer with smoked glass panels and a solid and stunning look” from http://www.cisl.ucar.edu/computers/gallery/cdc/3600.jsp ¾ several million dollars
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University of Virginia, MSE 4270/6270: Introduction to Atomistic Simulations, Leonid Zhigilei Current applications of the MD simulation technique Since the time the MD method was introduced, it has been used to investigate a wide range of problems in different research fields, e.g. Chemistry and Biochemistry : molecular structures, reactions, drug design, vibrational relaxation and energy transfer, structure of membranes, dynamics of large biomolecules, protein folding, … Statistical Mechanics and Physics : theory of liquids, correlated many-body motion, properties of statistical ensembles, structure and properties of small clusters, phase transitions. .
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This note was uploaded on 02/14/2012 for the course MSE 4270 taught by Professor Zhigilei during the Fall '11 term at UVA.

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MD_Part 2 - Control Data Corporation (CDC) 3600 at NCAR...

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