Revision
1210 -
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Modified
Wed Jan 23 03:45:33 2008 UTC
(17 years, 3 months ago)
by
gezelter
Diff to
previous 1200
Removed older version of openbabel from our code. We now have a
configure check to see if openbabel is installed and then we link to
the stuff we need. Conversion to OOPSE's md format is handled by only
one application (atom2md), so most of the work went on there.
ElementsTable still needs some work to function in parallel.
Revision
1083 -
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Modified
Fri Oct 20 14:59:05 2006 UTC
(18 years, 6 months ago)
by
gezelter
Diff to
previous 1079
more openbabel updates, also changing velocitizer to thermalizer to
avoid a filename collision on case-insensitve file systems
Revision
880 -
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Modified
Thu Feb 2 02:57:01 2006 UTC
(19 years, 3 months ago)
by
gezelter
Diff to
previous 858
added CXXFLAGS to the LinkOptions to allow compilation with icc9
(skipping the gcc-4 std c++ libraries).
Revision
832 -
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Modified
Fri Dec 30 15:32:55 2005 UTC
(19 years, 4 months ago)
by
tim
Diff to
previous 831
In order to compile MPI version, we need to cast const char* to void* for stringstream.str();
Previous Makefile use bjects of single version to make the MPI library;
Revision
775 -
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Modified
Fri Dec 2 20:10:30 2005 UTC
(19 years, 5 months ago)
by
gezelter
Diff to
previous 771
Change build process for libOOPSE.a so that the libraries aren't
unpacked. libOOPSE.a is now made directly from the object files
Revision
383 -
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Modified
Tue Mar 1 15:44:45 2005 UTC
(20 years, 2 months ago)
by
gezelter
Diff to
previous 340
Fixed the damned build problem with the libraries not
being removed in make clean and make distclean (at least
we think it is fixed).
Revision
340 -
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Modified
Tue Feb 15 05:05:33 2005 UTC
(20 years, 2 months ago)
by
gezelter
Diff to
previous 339
modifications to estimate memory in use by other processes
autoconf fixes
ps syntax checking
config.h file cleaning
Revision
242 -
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Modified
Mon Dec 20 20:50:56 2004 UTC
(20 years, 4 months ago)
by
chuckv
Diff to
previous 209
Fixed Makefile test bug under OSX and possibly other BSD's, replaced test -f *.mod with ls
function since BSD test apparently doesn't support wildcards.
Revision
25 -
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Modified
Thu Sep 30 15:41:35 2004 UTC
(20 years, 7 months ago)
by
tim
Diff to
previous 23
make clean is smart enough to only remove object files belong to current package.
turn off silent mode