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AgeCommit message (Expand)Author
2012-02-22Remove all remaining PDB rendering stuffThomas White
2012-02-22Remove water simulation stuffThomas White
2012-02-22Reduce the scope of "count"Thomas White
2010-06-05pattern_sim: Implement phased gradientsThomas White
2010-06-03Configure PDB filename for get_hkl and pattern_simThomas White
2010-03-29get_hkl: Only *save* reflections out to a certain resolutionThomas White
2010-03-29get_hkl: Generate reflections out to a certain resolutionThomas White
2010-03-26Don't try to render PDBs, part III: tidy up and fixThomas White
2010-03-25Improved PDB parserThomas White
2010-03-17Fix various memory leaks and tidy a few thingsThomas White
2010-01-15Update copyright datesThomas White
2009-12-16Update boilerplate commentsThomas White
2009-11-24Tidy up, fix thingsThomas White
2009-11-24Only calculate molecular transform at Bragg positionsThomas White
2009-11-23Centre the molecule before calculating structure factorsThomas White
2009-11-19Tidy up floating-point precisionThomas White
2009-11-17Move load_molecule to sfacThomas White
2009-11-17Move scattering factor stuff to new fileThomas White
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