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Free Objects for Crystallography 1352

 
Free Objects for Crystallography
Category: Utilities / Mac Utilities  
Author: objcryst.sourceforge.net | Published: Jul 24, 2012
License: Freeware | O/S: Windows/Mac/Linux , BSD
Uninstaller: no








Object-oriented crystallographic library and program, for the analysis of Crystal structures from scattering experiments: optimized scattering computation, Graphical interface for structures and data, global optimization algorithms. <br>View Crystal structures<br>Solve Crystal structure from diffraction data<br>Diffraction powder pattern auto-indexing<br>Simulate diffraction data (powder pattern and single crystal)

File Size: 5.9 MB   Price: $0.00   Downloads: 1
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Free Objects for Crystallography also mentioned on ShareMe

1.  pyHKL - Utilities/Other Utilities
... pyHKL is the interface to DENZO/SCALEPACK packages for X-ray crystallography data processing. It runs jobs remotely and aims at minimizing user input, by including automatic error model correction, rejection accumulation and mosaicity refinement. ...
 
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... SHAKERR provides the set of tools to evaluate the precision of macromolecular refinement in X-ray crystallography. It is based on shaking errors algorithm and provides interface to most popular refinement protocols (currently refmac and phenix). ...
 
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... Fityk is a program for nonlinear fitting of analytical functions (especially peak-shaped) to data (usually experimental data). There are also people using it to remove the baseline from data, or to display data only. Fityk is reportedly used in crystallography, chromatography, photoluminescence and photoelectron spectroscopy, infrared and Raman spectroscopy, to name but a few. Fityk knows about common peak-shaped functions (Gaussian, Lorentzian, Voigt, Pearson VII, bifurcated Gaussian, EMG, ...
 
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