A computer program based on Shake-and-Bake, a dual-space direct-methods procedure for determining crystal structures from X-ray diffraction data. www.hwi.buffalo.edu/SnB
Display and manipulation of crystal structures and simulation of diffraction patterns. Windows 95/98/NT platform. www.crystalsoftcorp.com/CrystalStudio
Qualitative and quantitative analysis of crystallographic textures. ODF calculation using both types of experimental data : pole figures (X-Ray,neutrons) or sets of individual orientations (EBSD,model calculations). www.labosoft.com.pl/ver20.htm
a UNIX-based software package for instrument control and data acquisition used for X-ray diffraction at synchrotrons and in university, national and industrial laboratories. www.certif.com
An advanced 3D visualization and modeling system, especially useful for displaying 3D image data and simulation results. Powerful segmentation tools and automatic geometry reconstruction help to generate surface models (e.g. VRML) from 3D image data. www.amiravis.com
Display molecules and molecular surfaces, optionally representing a field (for example electrostatic) as local colors. Silicon Graphics (IRIX) platform. trantor.bioc.columbia.edu/grasp
Directory of information for users of the "O" crystallographic package to model, display and build macromolecules. Silicon Graphics (IRIX) and Linux platform. imsb.au.dk/~mok/o
Software for macromolecular crystallography and structural biology. Many of these programs collaborate with "O" (see there). alpha2.bmc.uu.se/~gerard/manuals
System for solving and refinement of regular, modulated and composite structures from monocrystal and powder diffraction data. www-xray.fzu.cz/jana/jana.html
A versatile crystallographic program implementing a large variety of standard geometrical calculations, tests, utilities, graphics and several filters. Unix and Windows platforms. www.cryst.chem.uu.nl/platon
Real-time photo-realistic crystal structures program for Macintosh. Download a demo version - plus our free diffraction software and QuickTime VR movies. www.crystalmaker.co.uk
The software package for single crystal X-ray structure refinement and analysis consists of CRYSTALS, Cameron and specially recompiled versions of SIR92 and SHELXS. www.xtl.ox.ac.uk/crystals.html
AutoDock is a suite of automated docking tools. It is designed to predict how small molecules, such as substrates or drug candidates, bind to a receptor of known 3D structure. www.scripps.edu/pub/olson-web/doc/autodock
CaRIne is used for teaching crystallography and for research in materials science, chemistry and earth sciences. It brings real lattices, X-Ray diffraction diagrams, reciprocal lattices and stereographic projections all at the same time in a multi-windowe pro.wanadoo.fr/carine.crystallography
Software and methods source for molecular model visualization (Mage, JavaMage, Prekin); model validation via all-atom contact analysis (Probe, Reduce, MolProbity) and utility (Kincontour, Dang, Cluster, Bndlst, Atvol). Amino acid rotamers database for m kinemage.biochem.duke.edu
Open source software for solving crystal structures from powder diffraction data (or single crystal data) by Monte Carlo methods. www.cristal.org/sdpd/espoir
Forsiden | 
