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PACKMOL creates an initial point for molecular dynamics simulations by packing molecules in defined regions of space. The packing guarantees that short range repulsive interactions do not disrupt the simulations.
6 lines
264 B
Plaintext
6 lines
264 B
Plaintext
PACKMOL creates an initial point for molecular dynamics simulations by packing
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molecules in defined regions of space. The packing guarantees that short range
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repulsive interactions do not disrupt the simulations.
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WWW: http://m3g.iqm.unicamp.br/packmol/home.shtml
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