Resources - Апаратура

Връзки - Links

International Union of Crystallography - www.iucr.org
European Crystallographic Association - http://www.ecanews.org/
British Crystallographic Association - http://crystallography.org.uk/
American Crystallographic Association - http://www.amercrystalassn.org/
Asian Crystallographic Association - http://www.asiancrysassn.org/
Deutschen Gesellschaft für Kristallographie - http://www.dgkristall2.de/
Armenian Crystallographic Association - http://www.armcrysta.org/
Croatian Crystallographic Association - http://www.hazu.hr/kristalografi/
Hellenic Crystallographic Association - http://www.hecra.gr/index_en.htm
Turkish National Crystallographic Association - http://www.x-ray.gazi.edu.tr/
Czech and Slovak Crystallographic Association - http://www.xray.cz/xray/cryst.htm
Associazione Italiana di Cristallografia - http://www.cristallografia.org/
Indian Crystallographic Association - http://iris.physics.iisc.ernet.in/ica/
Nederlandse Vereniging voor Kristallografie - http://www.nvk.info/
Industrial Macromolecular Crystallography Association - http://www.imca.aps.anl.gov/
Swiss Society for Crystallography - http://www.sgk-sscr.ch/
The Society of Crystallogaphers in Australia and New Zealand - http://www.sca.asn.au/index.html

Software for Chemists and Material Scientists

Powder, Single crystal etc. equipment

Powder, XRF etc. diffractioon equipment

Powder, Single crystal etc. equipment

and

Low and high temperature devices for your equipment

Milling equipment

Equipment - DTA, DSC, electron microscopy etc.

Software

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

Olex2 - www.olex2.org

WinGX - http://www.chem.gla.ac.uk/~louis/software/

Crystals - www.xtl.ox.ac.uk/crystals.html

Oscail X - www.nuigalway.ie/cryst/oscail1.html

CCP14 Powder and Small Molecule Single Crystal Diffraction - http://www.ccp14.ac.uk/

CCP4 - http://www.ccp4.ac.uk/

PLATON - http://www.cryst.chem.uu.nl/platon/

Maud - Materials Analysis Using Diffraction (rietveld) - http://www.ing.unitn.it/~maud/

Fullprof suite - http://www.ill.eu/sites/fullprof/php/downloads.html

GSAS+EXPGUI - http://www.ccp14.ac.uk/solution/gsas/ or http://www.ncnr.nist.gov/xtal/software/gsas.html

Institute of Crystallography , Bari, Italy - http://wwwba.ic.cnr.it/content/software

• SIR2008: a widely used package for the solution and refinement of small single-crystal structures using either X-ray or electron diffraction data. Currently it has been merged into IL MILIONE.
• IL MILIONE: a suite of computer programs devoted to protein crystal structure determination by X-ray crystallography. The package contains the program Sir2008 for the solution and refinement of small structures.
• EXPO2009: an integrated package for the indexation of a powder diffraction pattern, the extraction of integrated intensities, the space group determination, the crystal structure solution via Direct Methods and/or by a direct-space/hybrid approach, and the structure refinement by the Rietveld technique.
• QualX: a computer program for phase identification using powder diffraction data.
• Quanto: a Rietveld program for quantitative phase analysis of polycrystalline mixtures from powder diffraction data.
• CAOS: the Crystal Analysis Operating System.

Crystallographic Software Database SINCRIS - http://ww1.iucr.org/sincris-top/logiciel/abc.html

Licenses required:

Bruker AXS TOPAS (Diffrac plus) - http://www.bruker-axs.de/topas.html

TOPAS Academic - http://www.topas-academic.net/#intro

PANalytical - HighScore Plus - http://www.panalytical.com/index.cfm?pid=547

PANalytical - Software - http://www.panalytical.com/index.cfm?pid=160

Bruker AXS - GADDS - http://www.bruker-axs.de/gadds.html

Molecular Visualisation Software

Mercury - www.ccdc.cam.ac.uk/products/mercury/

Crystalmaker - www.crystalmaker.com/

Diamond - http://www.crystalimpact.com/diamond/Default.htm

Coot - http://www.biop.ox.ac.uk/coot/

UCSF Chimera - http://www.cgl.ucsf.edu/chimera/

Pymol - http://www.pymol.org/

VESTA - http://www.geocities.jp/kmo_mma/crystal/en/vesta.html

VENUS - http://homepage.mac.com/fujioizumi/visualization/VENUS.html

Publication

International Union of Crystallography - www.iucr.org

British Crystallographic Association - http://crystallography.org.uk/

Checkcif - http://checkcif.iucr.org/

CSD Cambridge Crystallographic Data Centre - www.ccdc.cam.ac.uk/

Crystallograpghy Open Database - http://www.crystallography.net/

ICDD The International Centre for Diffraction Data - http://www.icdd.com/

ICSD inorganic crystal structures database - http://www.fiz-karlsruhe.de/icsd.html

PDB An Information Portal to Biological Macromolecular Structures - http://www.pdb.org/pdb/home/home.do (Protein data bank)

Reference

IUCr dicrionary of crystallography - http://reference.iucr.org/dictionary/Main_Page

IUCr teaching pamphlets - http://www.iucr.org/education/pamphlets

X-rayman forum - www.x-rayman.co.uk

Wikipedia - http://en.wikipedia.org/wiki/Category:Crystallography

For a very non-mathematical look at patterns of symmetry - http://www.tess-elation.co.uk/new-hom

Bilbao Crystallographic Server - http://www.cryst.ehu.es/

Blog on protein crystallography http://www.p212121.com/

People often ask us where they can by small consumable products such as cryoloops, pins, crystallisation plates and other useful tools. Here is a list of some useful sites, and some product numbers to get you started;

Hampton Research - www.hamptonresearch.com

Hampton Research offer cryoloops (HR4-953), magnetic mounts (HR4-665), magnetic bases for the goniometer head (HR4-943), Paratone oil for crystal manipulation (HR2-643), micro tools (HR4-811), Crystal wand for protein cryohandling (HR4-951), Cryotongs (HR4-667), goniometer heads (HR4-647) and many other products for crystal handling.

Mitegen - www.mitegen.com

Mitegen offer microloops, micromeshes, microgrippers and other micromounts. These are all made of a very low absorbing polymer, and are very good for mounting very small crystals. Mitegen also supply oils, magnetic mounts, microtools and other such products.

Huber - www.xhuber.de

Huber make particularly good goniometer heads. These are the heads which you receive with your original system purchase.

Almax - http://www.almax-industries.com/

Almax provide diamond anvil cells for high pressure experiments.