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AgeCommit message (Collapse)Author
2010-03-10Simulate with different parameters to the inputThomas White
2010-03-09indexamajig: Tidy up pattern simulationThomas White
2010-03-09get_hkl: simulated twinned dataThomas White
2010-03-08Fix and tidy-up the cell matchingThomas White
2010-03-08Fix a serious problem with the cartesian unit cell transformationThomas White
2010-03-08Cell matching: more tidy upThomas White
2010-03-08Choose the best fitting cell instead of the first matchThomas White
2010-03-08Tidy up and fix peak detection (carnage created by earlier refactoring)Thomas White
2010-03-05Report if a cell was found but not matchedThomas White
2010-03-05Fix problems with peak integrationThomas White
2010-03-05Read cell from PDBThomas White
2010-03-05More generous timeout for DirAxThomas White
2010-03-05New wavelength (1800 eV) in get_hklThomas White
2010-03-05forkpty() compatibilityThomas White
2010-03-04process_hkl: don't write output in results/, improve error message, output ↵Thomas White
ZA with --no-analyse --zone-axis
2010-03-04Clean up one more GLib thingThomas White
2010-03-03Add missing newlineThomas White
2010-03-03Stabilise DirAx stuff, and remove GLib dependencyThomas White
2010-03-03Kill zombiesThomas White
2010-03-03Comment out some more terminal noiseThomas White
2010-03-03Don't overrun image array boundariesThomas White
2010-03-03Don't forget to close FD for DirAxThomas White
2010-03-03Don't crash if a peak can't be mappedThomas White
2010-03-03Remove commented codeThomas White
2010-03-03Refuse to proceed without molecule.pdbThomas White
2010-03-03Tidy up another messageThomas White
2010-03-03Put many debug messages behind a --verbose optionThomas White
2010-03-03Fix domain of acos in angle_between()Thomas White
2010-03-02Clean up sinc LUTsThomas White
2010-03-02Take modulus when calculating sinc LUTThomas White
2010-03-01Fix build when OpenCL is disabledThomas White
2010-03-01Add new error codeThomas White
2010-03-01Use a lookup table for sinc values in GPU calculationThomas White
2010-02-27New default particle sizeThomas White
2010-02-27More tests for odd situationsThomas White
2010-02-27Do powder pattern as double precision floating pointThomas White
2010-02-27Fix type conversions to avoid trouble with overflows etc.Thomas White
2010-02-26Estimated crystal size for best estimate of signal levelsThomas White
2010-02-26New estimated fluenceThomas White
2010-02-26Fix and tidy up indexamajig --simulateThomas White
2010-02-26Fix rendering above saturation value (happens now, due to floating point ↵Thomas White
roundoff)
2010-02-26Separate DQE and detector gain (to make Poisson noise work)Thomas White
2010-02-26Water intensity should be be counted only once overall per pixelThomas White
2010-02-26Move water calculation to diffraction.c, and work out the consequencesThomas White
2010-02-26Handle images as floats rather than int16_tThomas White
Also, remove bloom - it's not a useful model for what really happens and takes too long (this isn't a detector simulation..)
2010-02-26Remove unused variableThomas White
2010-02-24'indexamajig' should use the indexed cell for simulation, not the model cellThomas White
2010-02-24Update --helpThomas White
2010-02-24indexamajig can use the GPU tooThomas White
2010-02-24Report maximum work group size and if it has been exceededThomas White
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