source: @ 41de6e

AutomationFragmentation_failures Candidate_v1.6.1 ChemicalSpaceEvaluator Enhanced_StructuralOptimization_continued Exclude_Hydrogens_annealWithBondGraph ForceAnnealing_with_BondGraph ForceAnnealing_with_BondGraph_contraction-expansion Gui_displays_atomic_force_velocity PythonUI_with_named_parameters StoppableMakroAction TremoloParser_IncreasedPrecision
Name Size Rev Age Author Last Change
build-aux 404d2b   8 years FrederikHeber Squashed 'ThirdParty/JobMarket/' content from commit e194722 …
data 37fe17   7 years frederik.heber TESTS: Added MD tests on methane, ethane, and water-filled system.
debian eca0d7   8 years FrederikHeber Set version to 1.6.0. - MoleCuilder library is now 17:0:1. - Codename …
doc 322d58   7 years frederik.heber ForceAnnealing now uses step width according to Barzilai-Borwein …
m4 aed262   8 years frederik.heber Upgraded boost.m4 from serial 22 to 26.
python 86f27c   8 years FrederikHeber DISTFIX: deps for cleanUp.cpp was removed in both src and python …
src 9bb8c8   7 years frederik.heber FIX: maxComponents was not chosen by absolute magnitude.
tests 41de6e   7 years frederik.heber TESTFIX: ForceAnnealing regression test used zero force. - all atoms …
ThirdParty a5c293   7 years frederik.heber FIX: SyncOperation now checks error codes from connect and close. - …
utils 719979   8 years FrederikHeber FIX: bash_completion is no longer installed in bin.
.gitignore 386 bytes fc5d2d   8 years FrederikHeber Removed *.in, *.swp, and *.m4 from gitignore which caused many …
AUTHORS 204 bytes de061d   8 years FrederikHeber Squashed 'ThirdParty/vmg/' content from commit f2885cd …
bootstrap 664 bytes d8a1ff   8 years FrederikHeber Modified present bootstraps to create ChangeLog only for respective …
ChangeLog 173 bytes de061d   8 years FrederikHeber Squashed 'ThirdParty/vmg/' content from commit f2885cd …
checkcommits.sh 4.4 KB dcc228   14 years FrederikHeber Added script to check all commits in a given range externally. - i.e. …
configure.ac 20.2 KB b10593   7 years frederik.heber Recreated all GuiChecks. - GuiChecks lacked …
COPYING 17.6 KB de061d   8 years FrederikHeber Squashed 'ThirdParty/vmg/' content from commit f2885cd …
INSTALL 15.2 KB de061d   8 years FrederikHeber Squashed 'ThirdParty/vmg/' content from commit f2885cd …
libmolecuilder_config.h.in 0 bytes 861874   14 years FrederikHeber libMolecuilderAction is now a shared lib via libtool. This is all …
LinearAlgebra-debug.pc.in 368 bytes ba3539   9 years FrederikHeber Package CodePatterns is now called libcodepatterns. - updated m4 …
makeDebianPackage.sh 1.1 KB 08d9df7   9 years FrederikHeber FIX: Rename codepatterns -> libcodepatterns. - updated …
Makefile.am 1.0 KB 4e8108   8 years FrederikHeber Libtool consolidates and updates itself through LIBTOOL_DEPS for all …
MoleCuilder.pc.in 465 bytes ba3539   9 years FrederikHeber Package CodePatterns is now called libcodepatterns. - updated m4 …
NEWS 0 bytes de061d   8 years FrederikHeber Squashed 'ThirdParty/vmg/' content from commit f2885cd …
README 937 bytes de061d   8 years FrederikHeber Squashed 'ThirdParty/vmg/' content from commit f2885cd …
test_all.sh 4.6 KB 490038   14 years FrederikHeber added --with-valgrind switch to configure script. - if given, we use …
TestRunnerClient.cpp 11.8 KB 084729c   8 years FrederikHeber Squashed 'ThirdParty/CodePatterns/' content from commit c1e1041 …
TestRunnerClient.h 4.1 KB 084729c   8 years FrederikHeber Squashed 'ThirdParty/CodePatterns/' content from commit c1e1041 …
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