Directory: Top/Science/Physics/Crystallography/Software

Top / Science / Physics / Crystallography / Software /

Crystals
The software package for single crystal X-ray structure refinement and analysis consists of CRYSTALS, Cameron and specially recompiled versions of SIR92 and SHELXS.
http://www.xtl.ox.ac.uk/crystals.html
Ox.ac.uk ~ Site Info Whois Trace Route RBL Check

AutoDock
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.
http://www.scripps.edu/pub/olson-web/doc/autodock/
Scripps.edu ~ Site Info Whois Trace Route RBL Check

CCP14 - Collaborative Computational Project Number 14
Freely available crystallographic software for single crystal and powder diffraction.
http://www.ccp14.ac.uk
Ccp14.ac.uk ~ Site Info Whois Trace Route RBL Check

SPEC / Certified Scientific Software
A UNIX-based software package for instrument control and data acquisition used for X-ray diffraction laboratories.
http://www.certif.com/
Certif.com ~ Site Info Whois Trace Route RBL Check

ESPOIR
Open source software for solving crystal structures from powder diffraction data (or single crystal data) by Monte Carlo methods.
http://www.cristal.org/sdpd/espoir/
Cristal.org ~ Site Info Whois Trace Route RBL Check

UMWEG and PSILAM
Programs for calculation and graphical representation of multiple diffraction patterns.
http://www.rrz.uni-hamburg.de/mpi/rossmanith/frame.html
Uni-hamburg.de ~ Site Info Whois Trace Route RBL Check

WinGX
System of programs for solving, refining and analysing single crystal X-ray diffraction data for small molecules. Provides a consistent and user-friendly GUI for some of the best publicly-available crystallographic programs. Interfaces to other popular p
http://www.chem.gla.ac.uk/~louis/software/wingx
Gla.ac.uk ~ Site Info Whois Trace Route RBL Check

ARITVE
Modelling amorphous structures by a Rietveld-type refinement of the atomic coordinates. Windows 9x/NT platform.
http://www.cristal.org/aritve.html
Cristal.org ~ Site Info Whois Trace Route RBL Check

CAOS
A crystallographic package for crystal structure determination from single crystal diffraction data.
http://www.ccp14.ac.uk/ccp/web-mirrors/caos/isc/caos/
Ccp14.ac.uk ~ Site Info Whois Trace Route RBL Check

TOPXD
Topological analysis program for experimental static electron density based on Hansen-Coppens multipole formalism.
http://harker.chem.buffalo.edu/public/topxd/
Buffalo.edu ~ Site Info Whois Trace Route RBL Check