-------------------------------------------------------------------------------- Fedora Update Notification FEDORA-2012-0834 2012-01-23 21:25:18 --------------------------------------------------------------------------------

Name : packmol Product : Fedora 16 Version : 1.1.2.023 Release : 1.fc16 URL : http://www.ime.unicamp.br/~martinez/packmol/ Summary : Packing optimization for molecular dynamics simulations Description : 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.

The great variety of types of spatial constraints that can be attributed to the molecules, or atoms within the molecules, makes it easy to create ordered systems, such as lamellar, spherical or tubular lipid layers.

The user must provide only the coordinates of one molecule of each type, the number of molecules of each type and the spatial constraints that each type of molecule must satisfy.

The package is compatible with input files of PDB, TINKER, XYZ and MOLDY formats.

-------------------------------------------------------------------------------- Update Information:

First release in Fedora. -------------------------------------------------------------------------------- ChangeLog:

-------------------------------------------------------------------------------- References:

[ 1 ] Bug #741626 - Review Request: packmol - Packing optimization for molecular dynamics simulations https://bugzilla.redhat.com/show_bug.cgi?id=741626 --------------------------------------------------------------------------------

This update can be installed with the "yum" update program. Use su -c 'yum update packmol' at the command line. For more information, refer to "Managing Software with yum", available at http://docs.fedoraproject.org/yum/.

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