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Free Objects for Crystallography

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Analyzed about 1 year ago. based on code collected about 1 year ago.

Commit Message	Contributor	Files Modified	Lines Added	Lines Removed	Code Location	Date
Dec 22, 2023 — Dec 22, 2024 Showing page 1 of 25 Search / Filter on:
Correctly erase temporary parameter set at the end of a SA run.	vincefn	More...				almost 20 years ago
Do not (wrongly) compute determinant when inverting matrix.	vincefn	More...				almost 20 years ago
Correctly delete the reflection profile.	vincefn	More...				almost 20 years ago
Nifty initialization and deletion of tabulated sine, cosine and exp tables.	vincefn	More...				almost 20 years ago
Correctly delete cctbx spacegroup object.	vincefn	More...				almost 20 years ago
Only initialize (free)glut once, when opengl window is closed/reopened.	vincefn	More...				about 20 years ago
Validate user input before importing a z-matrix.	vincefn	More...				about 20 years ago
Add tooltips.	vincefn	More...				about 20 years ago
Recompute geometrical structure factor when the used number of reflections has changed.	vincefn	More...				about 20 years ago
Use X-Ray tube name only if there is actually one given.	vincefn	More...				about 20 years ago
Remove old ($objectfile).gcda ($objectfile).gcno when compiling with profile=2.	vincefn	More...				about 20 years ago
Remove old ($objectfile).gcda ($objectfile).gcno when compiling with profile=2.	vincefn	More...				about 20 years ago
Enable profile feedback directed optimizations with gcc. First compile using "make profile=2", then run a few typical optimizations, then "make clean" and "make profile=3". Gain around 10% on speedtest. "make profile=1" will compile using the tau profiling package.	vincefn	More...				about 20 years ago
Correct "all" and "update" targets.	vincefn	More...				about 20 years ago
Remove static global list of scattering powers.	vincefn	More...				about 20 years ago
Update rules with correct search paths, plus commented out compile flags to compile with auto-vectorization.	vincefn	More...				about 20 years ago
Change declaration for compilation with gcc 3.3	vincefn	More...				about 20 years ago
Disable warnings when building freeglut, enable both gtk1 and gtk2 for wxWidgets.	vincefn	More...				about 20 years ago
Correctly initialize glut.	vincefn	More...				about 20 years ago
Compile wxWidgets and freeglut as static libraries by default, to lower dependencies.	vincefn	More...				about 20 years ago
Compile wxWidgets and freeglut as static libraries by default, to lower dependencies.	vincefn	More...				about 20 years ago
Avoid re-initializing spacegroup.	vincefn	More...				about 20 years ago
Add "restrict" keyword to independent pointers, to enable auto-vectorization. Also make sure that loop boundaries are constant for loops to be vectorized.	vincefn	More...				about 20 years ago
Update Makefile and XCode project for G5 target.	vincefn	More...				about 20 years ago
Update XCode project (now with XCode 2.2, but should work with 2.1). Update Makefile.	vincefn	More...				about 20 years ago
Added export to z-matrix from a Molecule.	vincefn	More...				about 20 years ago
Add the ability to use "Ghost" atoms using Maximum Likelihood - they have an unknown position, and only contribute to the variance of the structure factor, not to the modulus.	vincefn	More...				about 20 years ago
Use explicit type for log() to compile with VC++.	vincefn	More...				over 20 years ago
Correct typo (extra Molecule::)	vincefn	More...				over 20 years ago
Switch to XCode rather than Makefile building, keep macosx.mak for command-line control of XCode and disk image generation.	vincefn	More...				over 20 years ago

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