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applications/engineering
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DRAWxtl -
DISPLAYS CRYSTAL STRUCTURES
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EDMA -
Analysis of discrete elecron density maps
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cctbx -
Computational Crystallography Toolbox
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crystals-cmd -
CRYSTALS X-ray structure refinement and analysis
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flipsmall -
Prepares input file for Superflip and EDMA
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jana -
Structure analysis of crystals periodics from diffraction data
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objcryst-fox -
Viewing and solving crystal structures from powder diffraction data
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platon -
PLATON is a versatile SHELX97 compatible multipurpose crystallographic tool
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python-openopt -
A python module for numerical optimization
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superflip -
Application of the charge-flipping algorithm
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tonto-chem -
Tonto is a free package for doing quantum chemistry simulations