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Search results for molecule crystallography
crystallography
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molecule
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6 search results found
Cctbx_project
⭐
197
Computational Crystallography Toolbox
Robocrystallographer
⭐
70
Automatic generation of crystal structure descriptions.
Chmpy
⭐
15
Spherical harmonic shape descriptors, promolecule densities, isosurfaces and Hirshfeld surfaces in python
Finalcif
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11
A CIF file finalizer for small molecule crystallography with as much automation as possible.
Shelxfile
⭐
9
A parser and editor for SHELXL files.
Dsr
⭐
5
Refinement of disordered structures with SHELXL
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1-6 of 6 search results
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