Skip to Content


  Crystallography: Software

Home > Crystallography > Software

Software (Subscribe)

Links

1 2 3 > >|

sms messaging online

http://www.sendgroupsms.com

Send sms from pc tool is having capabilities to reduce redundancy of phone numbers from group of recipients make sure efficient use of network resources.

Review It Rate It Bookmark It

UMWEG and PSILAM popular

http://www.rrz.uni-hamburg.de/mpi/rossmanith/frame.html

Programs for calculation and graphical representation of multiple diffraction patterns.

Review It Rate It Bookmark It

TOPXD popular

http://harker.chem.buffalo.edu/public/topxd/

Topological analysis program for experimental static electron density based on Hansen-Coppens multipole formalism.

Review It Rate It Bookmark It

ReX popular

http://www.rexpd.com/

A program based on the Rietveld method that allows to perform quantitative and structural analyses starting from powder diffraction data. Windows, Mac and Linux platforms.

Review It Rate It Bookmark It

Xtal

http://xtal.sourceforge.net/

A package of over sixty programs for calculations ranging from the reduction of raw diffraction intensities, to the solution, refinement and publication of crystal structures. These are applicable to X-ray, neutron and electron diffraction analyses, including charge density studies. The package contains interactive graphics tools and is available as execution modules for most common platforms.

Review It Rate It Bookmark It

XPowder

http://www.xpowder.com/

A program for qualitative (PDF2 data base) and least-square full-profile quantitative analysis of phases in crystaline and amorphous powder samples by X-Ray diffraction. Windows platform.

Review It Rate It Bookmark It

WinGX

http://www.chem.gla.ac.uk/~louis/software/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 programs such as SHELXL-97 and SIR-97.

Review It Rate It Bookmark It

TOPOS

http://www.topos.ssu.samara.ru/

A program package for multipurpose geometrical and topological analysis of crystal structures. It works with crystal structure databases.

Review It Rate It Bookmark It

The Area Diffraction Machine

http://code.google.com/p/areadiffractionmachine/

The project homepage of the Area Diffraction Machine, an open source program for performing general two dimensional diffraction data analysis.

Review It Rate It Bookmark It

Symmation

http://www.symmation.com/

Accurate 3D medical/molecular/scientific animations and illustrations.

Review It Rate It Bookmark It

SPEC / Certified Scientific Software

http://www.certif.com/

A UNIX-based software package for instrument control and data acquisition used for X-ray diffraction laboratories.

Review It Rate It Bookmark It

SnB

http://www.hwi.buffalo.edu/SnB/

A computer program based on Shake-and-Bake, a dual-space direct-methods procedure for determining crystal structures from X-ray diffraction data.

Review It Rate It Bookmark It

SNAP Software

http://www.chem.gla.ac.uk/snap/

Software packages designed to match and analyse powder diffraction patterns utilising their full profiles; dSNAP is a new software package to help users automatically classify and visualise the results of database searches using the CSD.

Review It Rate It Bookmark It

SHELX-97

http://shelx.uni-ac.gwdg.de/SHELX/

Set of programs for crystal structure determination from single-crystal diffraction data. Runs on all systems including DOS.

Review It Rate It Bookmark It

SHARP

http://www.globalphasing.com/sharp/

A computer program for refining a model of isomorphous heavy-atom substitution and calculating phase probabilities from it. Irix and Linux platforms.

Review It Rate It Bookmark It

RPluto

http://www.ccdc.cam.ac.uk/free_services/rpluto/

An X-windows tool for visualising molecular crystal structures on UNIX (including Linux) platforms.

Review It Rate It Bookmark It

Richardson Lab Web Site: 3D Analysis Software

http://kinemage.biochem.duke.edu/software/

Software and methods source for molecular model visualization, model validation via all-atom contact analysis and utility. Linux, Mac, SGI, Sun, and Windows platforms.

Review It Rate It Bookmark It

RAD, FIT, PEDX, IFO

http://www.pa.msu.edu/~petkov/software.html

RAD - program for analysis of X-ray diffraction data from amorphous materials. FIT - program for decomposition of powder diffraction patterns and profile analysis of pair correlation functions. PEDX - program for radial-distribution-function analysis of energy-dispersive X-ray diffraction data from disordered materials. IFO - program for image-reconstruction-type calculation of atomic distribution functions for disordered materials.

Review It Rate It Bookmark It

Queen of Spades

http://www.mbg.duth.gr/~glykos/Qs.html

Implementation of a Molecular Replacement method which simultaneously determines the rotational and translational parameters of all copies of a search model in the crystallographic asymmetric unit of a target structure. Unix, VMS and Windows platforms.

Review It Rate It Bookmark It

publCIF

http://journals.iucr.org/services/cif/publcif/

Free software to edit and preview a CIF for publication. Windows, Linux and MacOS platforms.

Review It Rate It Bookmark It

PowDLL

http://users.uoi.gr/nkourkou/

A .NET dynamic link library used for the interconversion procedure between variable formats of Powder X-Ray files. The DLL is capable of handling 14 file formats (binary and ASCII).

Review It Rate It Bookmark It

1 2 3 > >|