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Dynamic Partitioning via the Seed Atom Method

In some simulations, like that of large biological systems that involve reactive sites and proton transfer, the choice of a reactive region does not change while the [Pg.47]

QM reaction center (MSINDO) - 10 tMh.r radius around F( P) atom. [Pg.48]

Gassical torce fieid (0PL5-AA) treatment of liquid, [Pg.48]

See other pages where Dynamic Partitioning via the Seed Atom Method is mentioned: [Pg.47]

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Atom dynamics

Atomization methods

Atoms methods

Dynamic method

Dynamic partition

Dynamic partitioning

Method seeding

Partition method

Partitioning methods

Partitive method

Seed atom