81. Chemical Crystallography Oxford: Home Research activities, staff contact information, software and photo galleries of the Xray crystallography laboratory at the University of Oxford. http://www.xtl.ox.ac.uk/

@import url(chemcryst.css); /*IE and NN6x styles*/ Chemical Crystallography Laboratory University of Oxford This short bit of text is rendered with the "display:none" style. If you can see it you may wish to upgrade to a web standards compliant web browser... Otherwise, don't worry, the content of this site is still accessible! Menu Home CRYSTALS Software Research Contact Information Links ... Search News CRYSTALS build 1190 is available for testing. The manuals are available as PDF files Added section on resources for postgraduate students to links. 2003: Chemical Crystallography Lab is due to move buildings this year. Quick links Chemical Crystallography Laboratory is located in the white house with white shutters just by the junction of Parks Road and South Parks Road. Inside this Georgian style listed building we have state of the art crystallographic diffraction equipment, laboratory space for sample preparation, office space for computational work, and office space for the Mathematical and Physical Sciences Division The Watkin group currently consists of two post doctoral researchers, two D.Phils, an MSc student and four

82. Univ. West. Australia Crystallography Centre http://www.crystal.uwa.edu.au/

83. Katedra Krystalografii Studies of structures and phase transitions. http://alpha.uni.opole.pl/pracowniaang.html

84. Geneva University - Laboratory Of Crystallography Translate this page Laboratoire de Cristallographie. Le Laboratoire de Cristallographieest à la Faculté des Sciences de l'Université de Genève. http://www.unige.ch/crystal/lab.html

Laboratoire de Cristallographie de l' Adresse postale Laboratoire de Cristallographie 24 quai Ernest-Ansermet Switzerland E-mail: secretariat@cryst.unige.ch Laboratoire Fax: +41 22 702 61 08 E-mail collectif: Voir Web: http://www.unige.ch/crystal/lab.html personel (Phone/Email/Bureau/Adresse) et Personnel Aitken Bernardinelli Mao , Shao Yu Cerny , Radovan [ Page personnelle Filinchuk , Yaroslav [ Page personnelle Flack , Howard [ Page personelle Gomes , Sandrine Lorenzoni , Jean-Luc Renaudin , Guillaume , Jean-Philippe Tokaychuk , Yaroslav Yvon , Klaus [ Page personnelle Visiteurs , Birgitta Enseignement Listes officielles annuelles Informations provenant des enseignants , R. Cerny , H. D. Flack , R. Cerny Cristallographie , K. Yvon Cristallochimie , K. Yvon Publications Liste de publications Directions pour le visiteur et d'autres informations

85. World Wide Web For Crystallography World Wide Web for crystallography. HD Flack Laboratoire de Cristallographie,University of Geneva, Switzerland. 2. W3VL crystallography. http://www.unige.ch/crystal/ahdf/nist.www.html

86. Molecular Structure Laboratory The laboratory deals with molecular structure by employing both experimental techniques, such as Xray crystallography, and the methods of computational and quantum chemistry. http://faculty.virginia.edu/molecular-structure/

Dr. Michal Sabat, Laboratory Director Phone: (434)-924-7862 E-mail: ms5c@virginia.edu Created in 1990, the laboratory deals with all aspects of molecular structure by employing both experimental techniques, such as X-ray crystallography, and the methods of computational chemistry, including molecular mechanics, molecular dynamics and quantum chemical calculations. The laboratory consists of two units: The X-ray diffraction facility The molecular modeling laboratory Above: Structure of a (G.A) DNA hairpin. Molecular dynamics calculations (AMBER 6) were performed by Michael Keller, who is currently researching the effects of zinc (II) on the stability of various DNA hairpins. Above: Structure of a platinated DNA G.GC triplex. Molecular dynamics calculations (AMBER 5) were performed by Evan Kransdorf, presently in the MD/PhD program at the Virginia Commonwealth University School of Medicine. Address: Department of Chemistry University of Virginia McCormick Road Charlottesville, VA 22904

87. Crystallography Education Web Sites crystallography Education Web Sites. Compiled by. Learning crystallography.International Union of crystallography (IUCr) teaching pamphlets. http://www.hwi.buffalo.edu/ACA/educationsites.html

Crystallography Education Web Sites Compiled by Katherine Kantardjieff and Virginia Pett updated 9/00 (Send additional sites to pett@acs.wooster.edu If you would like to report a bad link on this page please email aca@hwi.buffalo.edu Learning Crystallography International Union of Crystallography (IUCr) teaching pamphlets Kevin Cowtan's Book of Fourier and The Interactive Structure Factor Tutorial Isomorphous Replacement (a splendid site maintained by Ian Tickle and Huub Driessen) MAD Phasing (Ethan Merritt's BSC site at Washington U. School of Medicine) ... "How To Solve a Structure By X-ray Crystallography" or How To Understand How the Experts Do It" or "How To Understand What It All Means" by Manfred S. Weiss Teaching Crystallography X-Ray and Neutron Diffraction (by Neder and Proffen) Animations of Physical Processes The Point Group Tutorial: Software for Chemical Education Kevin Cowtan's Picture Book of Fourier Transforms How to see in stereo ... The Molecular Structure of Green Fluorescent Protein Crystallography Resources Richard's Favourite Crystallographic WWW Sitesdatabase links (Stroud's site at UCSF) Sincris Information Server for Crystallography (biology, chemistry, minerology, physics, diffraction theory, software, laboratories, etc)

88. IMB Jena, Germany Department of Structural Biology crystallography http://www.imb-jena.de/www_sbx/sbx.html

89. IUCr - International Union Of Crystallography Serves the world community of crystallographers. http://www.iucr.org/

International Union of Crystallography Welcome to the International Union of Crystallography This server supplies information on crystallography from the IUCr, and pointers to other information services of interest to crystallographers. Mirror sites Please select the site that will provide you with the best network response: IUCr offices , Chester, England Europe: France Europe: Israel (courtesy Weizmann Institute of Science, Rehovot) Europe: Russia (courtesy Institute of Problems of Chemical Physics, Chernogolovka) Europe: Sweden (courtesy Dept. Structural Chemistry, University of Stockholm) Europe: Switzerland (courtesy University of Geneva) North America (courtesy San Diego Supercomputing Center) Mexico Asia and Oceania: Australia (courtesy University of Western Australia) Asia and Oceania: Japan (courtesy Tokyo Institute of Technology) South Africa (courtesy Dept. Structural Chemistry, University of the Witwatersrand) IUCr Webmaster

90. Linux Applications In Crystallography since the 5th of October 1998. Linux Applications in crystallography. The belowlisted applications are directly or indirectly related to crystallography. http://www.fos.su.se/struc/linux/linuxtal.html

Last updated 12 th of October 1998 You are visitor no. since the 5th of October 1998. Linux Applications in Crystallography The below listed applications are directly or indirectly related to crystallography. Many of the program descriptions are extracted from SINCRIS. A majority of the listed programs need to be compiled by a FORTRAN 77 or C -compiler (or both) i.e . there are not so many binary distributions of the applications. I have designated macromolecular programs with [MM] , organic [ORG] and inorganic [INORG] Freeware or shareware programs for academic use are designated and commercial programs The programs have been divided in four groups: Structure determination (solution and refinement), Data collection Graphics (viewers, modelling etc.), Miscellaneous (absorption correction, Voronoi calculations etc.). People are more than welcome to contribute to this list. However, be sure that the program really runs under Linux OS before submitting your Linux software links. Please send an e-mail to Klas Andersson klasa@struc.su.se

91. Laboratory Of Crystallography Translate this page http://www.uni-bayreuth.de/departments/crystal/

92. Crystallography Resources Resources relating to crystallography, including Databases, Journals, ResearchGroups, General Resources, Societies and Software. Contact Webmaster Site Map http://www.netaccess.on.ca/~dbc/cic_hamilton/crystal.html

Agricultural Chemistry Analytical Chemistry Biochemistry Chemical Education ... Cambridge Structural Database Contains structural information for over 200,000 organic and metal organic compounds CRYSTMET A compilation of crystallographic and bibliographic data for metallic structures determined by diffraction methods. Crystal Structures Database Compiled by Indiana University's Molecular Structure Center Inorganic Crystal Structure Database Acta Crystallographica Section A Foundations of Crystallography Published by the International Union of Crystallography Acta Crystallographica Section B Structural Science Published by the International Union of Crystallography Acta Crystallographica Section C Crystal Structure Communications Published by the International Union of Crystallography Acta Crystallographica Section D Biological Crystallography Published by the International Union of Crystallography American Crystallographic Association Newsletter Crystallography Reviews Crystal Research and Technology A Journal of Experimental and Industrial Crystallography Published by: Wiley-VCH CrystEngComm Royal Society of Chemistry Publication Journal of Applied Crystallography Published by the International Union of Crystallography Journal of Chemical Crystallography Materials Structure in Chemistry, Biology, Physics and Technology

93. CSCA Association bulletin and crystallography resources. http://www.xray.cz/xray/cryst.htm

CSCA Krystalograficka spolecnost Czech and Slovak Crystallographic Association Sidlo: Ustav makromolekularni chemie AV CR, 162 06 Praha 6, ICO: 18628192 Seminars and Conferences ROZHOVORY CONFERENCES Local seminars Materials Structure Bulletin of the Crystallographic Association. Experimental X-Ray Laboratories Related Societies Home pages of other societies Institutions Home pages of mother institutions of CSCA members Software ZDS - system Marching Cube ELD Difpatan Organization Volby vedecke rady 2000 - vysledky Platba Krystalograficke spolecnosti Synchrotron radiation Synchrotronove zareni Members Search in the CSCA list Hledání v seznamu èlenù a jeho doplnìní Neutron Scattering Rozptyl neutronu Vacancies Czech Republic Germany Australia France Offers Seifert diffractometer Dron diffractometer Electron microscope Links to other servers: International Union of Crystallography European Crystallographic Association - www.xray.cz/eca International X-Ray Analysis Society Original server of CSCA - Institute of Physics European Crystallographic Association First crystallographic server of the CSCA in Bratislava History International Meetings Czecho - Slovak Meetings ECM-18 4th Autumn school X-ray scattering from surfaces and thin layers 3rd Autumn school X-ray scattering from surfaces and thin layers ICDD - Workshop Regionalni konference o praskove difrakci (RPDK) Kolokvium - STRUKTURA'99 6. regionalni konference o praskove difrakci

94. Crystallography CSD DESCRIPTION, LINKS. The Cambridge Structural Database (CSD) isthe only comprehensive collection of smallmolecule organic and http://cds.dl.ac.uk/cds/datasets/crys/crystal.html

DESCRIPTION LINKS The C ambridge S tructural D atabase (CSD) is the only comprehensive collection of small-molecule organic and organometallic crystal structures. The QUEST and ConQuest software has been developed for the search, retrieval, display and analysis of CSD information. The database contains crystal structures for over 224,000 organic and organometallic compounds. A new release of the database is received and mounted every 6 months. CSSR (C rystal S tructure S earch and R etrieval) software was developed in house at Daresbury and is an inverted form of the CSD data. CCDC (Cambridge Crystallographic Data Centre) QUEST ConQuest ConQuest User Guide and Tutorials ... Flash movies. Quick Overview of ConQuest and more detailed introductions to searches and results. CCDC Introductory Guide CSSR CSSR News Items MERCURY ... CrystalWeb DESCRIPTION Bibliographic (author, journal etc.) and cell data searching of the crystallographic databases. Uses the Chime plugin for displaying structures and the reference is automatically LitLink enabled, giving single click access to electronic literature.

95. Nature Of 3D Structural Data Some molecules have been studied both by crystallography and by solution NMR, andin these cases the agreement has been excellent. XRay crystallography. TOC. http://www.rcsb.org/pdb/experimental_methods.html

Nature of 3-D Structural Data PDB Home Contact us Contents: Origins and Limitations of 3D Structural Data X-Ray Crystallography Solution Nuclear Magnetic Resonance Origins and Limitations of 3D Structural Data TOC Most of the three-dimensional macromolecular structure data in the Protein Data Bank were obtained by one of three methods: X-ray crystallography (over 80%), solution nuclear magnetic resonance (NMR) (about 16%) or theoretical modeling (2%). A few structures were determined by other methods (see Experimental Technique in SearchFields ). The first two are experimental methods. The empirical results of these experimental methods accurately describe the 3D structure of the molecule in the state in which measurements were made (provided the authors did not misinterpret the data, which happens on rare occasions). Crystallization sometimes distorts portions of a structure due to contacts between neighboring molecules in the crystal (e.g. malate dehydrogenase/ , see Crystallography Made Crystal Clear , Rhodes , p. 34). However, protein crystals as used for diffraction studies are highly hydrated ("wet and gelatinous") so structures determined from crystals are not much different from the structures of soluble proteins in aqueous solution. Some molecules have been studied both by crystallography and by solution NMR, and in these cases the agreement has been excellent. An early example is thioredoxin from E. coli

96. Our Pages Have Moved You will be automatically transferred to the new crystallography at the NSLSpage in 15 seconds or you may click on the link to go there directly http://www.x12c.nsls.bnl.gov/x12c/nsls_px.html

Our Web-Pages Have Moved! You will be automatically transferred to the new Crystallography at the NSLS page in 15 seconds or you may click on the link to go there directly: http://www.px.nsls.bnl.gov Last modified 4 April 2001 by Protein Crystallography Web Master

97. Virtual Crystallography Page The images you see spinning and morphing between shapes are animatedGIF images created by me, Albert Hines. They are built using http://www.novagate.com/~ahines/rocks/vir_cris.htm

The images you see spinning and morphing between shapes are animated GIF images created by me, Albert Hines. They are built using image/video capability on Silicon Graphics workstations. I've made them specifically to simulate the various habits exhibited by minerals. The diagram at left shows very briefly how the system works. The a, b, and c lines show rows of molecules. The blue plane represents a crystal face. The index tells which molecules lie on the crystal face plane by taking the reciprocal of the intersection of the crystal plane with the axis. The image below represents the forms possible as a cubic crystal takes on a more and more octahedral habit, common in fluorite, galena, and other isometric minerals. The faces of the cube, in terms of their Miller index, are: where the minus corresponds to a barred, or negative, value. Since in the isometric system, lattice axes are all mutually orthogonal and the scales are equal, the indices are x,y,z intercepts of a plane defining the face, e.g. indicates a plane with three points: (1,0,0),(0,1,0),(0,0,1).

98. EPSRC National Crystallography Service to the web site for the EPSRC UK National crystallography Service in the Chemicalcrystallography Laboratory at the Department of Chemistry, University of http://www.soton.ac.uk/~xservice/

Welcome to the web site for the EPSRC UK National Crystallography Service in the Chemical Crystallography Laboratory at the Department of Chemistry, University of Southampton. These pages provide a description of the Service and the facilities available together with information on how to request access. We hope the information given will be useful and cordially invite comments and suggestions for improvements and additions. Please mail to ale1@soton.ac.uk Download the 2003 application for a full allocation in MSWORD format by clicking here SERVICES ACCESS TO THE SERVICE HOME ACCESS SERVICES ... LINKS Last edited 06/03/2001 by Simon Coles Department of Chemistry University of Southampton Highfield Southampton. SO17 1BJ Tel: (023) 80596722 Fax: (023) 80596723 General enquiries: ale1@soton.ac.uk

99. SINCRIS Software List Database of software for crystallography. http://www.lmcp.jussieu.fr/sincris/logiciel/#liste

Software Contents Software for Crystallography How to use ftp and other Internet tools? Advertisment Papers on software in J. Applied Crystallography The editor cannot answer to technical questions about software he did not write! Please direct your questions to the authors. For educational software, please look also in CWW Teaching and Education section. Software database for crystallography Search the database (not available for the moment) Full list New contribution to be submitted to the editor: Message to the Editor Any question should be directed to the author or to the Editor, Yves.Epelboin@lmcp.jussieu.fr SInCris Editor

100. Crystallography UT Southwestern Structural Biology Group Science News Journals InstitutionsTravel crystallography Biophys. Chem. crystallography. Crystallization. http://www.hhmi.swmed.edu/external/crystallography/crystallography.html

Crystallography Crystallization Data Processing Phasing Packages Refinement ... Tutorials Please report missing, incorrect or invalid links to webmaster@www.hhmi.swmed.edu Page Last Modified: Feb 4, 1999

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