source: molecuilder/src/helpers.cpp

Revision Log Mode:


Legend:

Added
Modified
Copied or renamed
Diff Rev Age Author Log Message
(edit) @543ce4   16 years FrederikHeber Huge change from ofstream * (const) out --> Log(). - first shift was …
(edit) @20895b   16 years FrederikHeber Extension to the periodic boundary case for analysis_correlation.cpp …
(edit) @543794   16 years FrederikHeber flip() is now templated. Signed-off-by: Frederik Heber …
(edit) @a2db10   16 years FrederikHeber performCriticalExit() must not be defined static. Note that static …
(edit) @ff9879   16 years FrederikHeber First half of molecule_fragmentation.cpp refactoring. - new template …
(edit) @e71890   16 years FrederikHeber Merge branch 'new-delete-conversion' into CodeRefactoring Conflicts: …
(edit) @17b3a5c   16 years FrederikHeber forward declarations used to untangle interdependet classes. - …
(edit) @53f32e   16 years Saskia Metzler temp commit
(edit) @8ffe32   16 years FrederikHeber More functions of molecule now use templated iterators. - the …
(edit) @729279   16 years Saskia Metzler #22 Write a critical exit function
(edit) @14db08   16 years Saskia Metzler #19 Observe memory usage
(edit) @390a2b   16 years Saskia Metzler Ticket 11: use templates and/or traits to fix Malloc/ReAlloc-Free …
(edit) @a048fa   16 years FrederikHeber fixed indentation from tabs to two spaces.
(edit) @c830e8e   16 years FrederikHeber Basic implementation of Multiple molecules. builder.cpp: - …
(edit) @e08f45   17 years FrederikHeber Merge branch 'ConcaveHull' of ../espack2 into ConcaveHull Conflicts: …
(edit) @45105b   17 years FrederikHeber New function IsValidNumber(): checks whether a command line argument …
(edit) @7b67a3   17 years FrederikHeber Splitting MatrrixContainer::ParseMatrix in ParseMatrix ParseMatrix …
(edit) @3b1427   17 years FrederikHeber BUGFIX: single letter FragmentNumbers gave "\n" as return string. …
(edit) @f75030   17 years FrederikHeber Lots of for loops now count in reverse order where it does not matter, …
(edit) @38fc0d   17 years FrederikHeber Free(): only set to NULL if it was free'd otherwise it is already
(edit) @da83f8   17 years FrederikHeber added --enable-optimization, thrown -g -O specifics out of …
(add) @a0bcf1   17 years FrederikHeber -initial commit -Minimum set of files needed from ESPACK SVN …
Note: See TracRevisionLog for help on using the revision log.