--- trunk/OOPSE-4/src/applications/randomBuilder/randomBuilder.ggo 2006/10/09 22:16:44 3035 +++ trunk/OOPSE-4/src/applications/randomBuilder/randomBuilder.ggo 2006/10/10 02:44:13 3036 @@ -2,18 +2,18 @@ package "simpleBuilder" # for parsing command line arguments useing getopt and getoptlong. # gengetopt is available from: # http://www.gnu.org/software/gengetopt/gengetopt.html -package "simpleBuilder" +package "randomBuilder" version "1.0" # Options -option "output" o "Output file name" string no -option "latticetype" - "Lattice type string. Valid types are fcc,hcp,bcc and hcp-water." string default="fcc" no +option "output" o "Output file name" string yes +option "latticetype" - "Lattice type string. Valid types are fcc,hcp,bcc and hcp-water." string default="fcc" no option "density" - "density (g/cm^3)" double yes option "nx" - "number of unit cells in x" int yes option "ny" - "number of unit cells in y" int yes option "nz" - "number of unit cells in z" int yes -option "molFraction" - "(Default) Builds a multi-component random mixed nanoparticle. Mole Fraction must be specified for each componet > 1 in MD file." double no multiple -#option "a1" - "lattice spacing in Angstroms h - for cubic lattice, specify this parameter" double no -#option "a2" - "lattice spacing in Angstroms k" double no -#option "a3" - "lattice spacing in Angstroms l" double no +option "molFraction" - "(Default) Builds a multi-component random mixed nanoparticle. Mole Fraction must be specified for each componet > 1 in MD file." double no multiple +#option "a1" - "lattice spacing in Angstroms h - for cubic lattice, specify this parameter" double no +#option "a2" - "lattice spacing in Angstroms k" double no +#option "a3" - "lattice spacing in Angstroms l" double no