fixes for configure
Added a bunch of Make.dep files to CVS
removed mpi++ from the makefile
fixed a typo in the makefile.
add conserved quantity to statWriter fix bug of vector wrapping at NPTi
Changes to autoconf / configure method of configuring OOPSE
added define statemewnt to Statwriter and Dumpwriter to handle files larger than 2 gb. commented out some print statements in Zconstraint hard coding some system init into bilayer.sys
More FreeBSD fixes
updated the Changelog. added some bug fixes for setting the random number generator seed value. fixed a bug where ghostbend atom b was not being set. ( recent bug from SimState conversion)
quick makefile fix, in make links. added -f to ln -s.
Fixed sysBuild -bilayer works. Nanobuilder still broke.
Added comment line for getgetopt.
Missed del of files before.
*** empty log message ***
commit makefile
Changed makefile to only build quicklate.
Arranged sysbuilder into a subdirectory. Fixed some of sysbuilder to work with new atom allocation in libmdtools.
Made quickLate aware of Hmat. quickLate is now somewhat more intelligent about periodic boundaries and wrapping.
added more command line arguments
Broken SysBuilder
added a nanoSysBuilder that takes different cmd line arguments.
Fixed Hmat and some namespace strangeness
Added nanoBuilder and a general Lattice builder.
cleaned up the dependecy scripts in the makefiles
fixed the bugs introduced by switching the periodic box to a matrix
Most of the integrator and NVT seem to be working now.
currently modifiying Symplectic to become the basic integrator. bilayerSys.cpp altered for building tb3.
all seems to be working
still working on the bilayer code
doing some work to overhaul sysbuild.
i quick fix to th distance in the random bilayer builder
fixed up sysBuild to where it should now build our systems
almost finished.
bilayerSys and sysBuild both will build now. woot!
finished bilayerSys.cpp sysBuild still need to write the bass file. MoLocator.cpp is currently empty
working on the system builder
working on a system builder
added Ghost bends to the TraPPE_Ex forceField added sysBuild to the utils Makefile
Changed Readme, added some files