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Molecular dynamics equations of motion for systems varying in shape and size

โœ Scribed by Ray, John R.


Book ID
118122016
Publisher
American Institute of Physics
Year
1983
Tongue
English
Weight
429 KB
Volume
79
Category
Article
ISSN
0021-9606

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Quasi-Hamiltonian equations of motion fo
โœ Mazur, Alexey K. ๐Ÿ“‚ Article ๐Ÿ“… 1997 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 215 KB ๐Ÿ‘ 2 views

Conventional molecular dynamics simulations of macromolecules require long computational times because the most interesting motions are very slow compared to the fast oscillations of bond lengths and bond angles that limit the integration time step. Simulation of dynamics in the space of internal co