freebsd-ports/science/packmol/pkg-descr
Jason W. Bacon d7784cdd16 science/packmol: Pack molecules in defined regions of space
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.
2019-09-22 19:06:43 +00:00

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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.
WWW: http://m3g.iqm.unicamp.br/packmol/home.shtml