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Numerical integration of the cartesian equations of motion of a system with constraints: molecular dynamics of n-alkanes | NobleBlocks
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Numerical integration of the cartesian equations of motion of a system with constraints: molecular dynamics of n-alkanes
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Numerical integration of the cartesian equations of motion of a system with constraints: molecular dynamics of n-alkanes
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NobleBlocks
on Mar 1, 1977 • 12:00 AM UTC
Authors:
Jean-Paul Ryckaert
,
Giovanni Ciccotti
,
Herman J. C. Berendsen
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Cartesian coordinate system
Holonomic constraints
Verlet integration
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