References: ACNUC Entered: Mon Jan 27 10:59:ĭescription: ACNUC is a retrieval system for the nucleotide sequence Calculates f' and f'' based on theoretical work of CromerĪnd Liberman calculates Rayleigh and Compton cross-section based on References: ABSORB Entered: Tue Jan 07 16:32:ĭescription: Brennan-Cowan X-ray absorption, reflection and dispersionĬalculation. Rendered 3D pictures from the same view as ORTEX direct from Shelx.INS RASTEP and RENDER have been added to the system giving realistic Plots, mouse based interactive editing of Shelx files with auto atom 29,306ĭescription: Study and display of crystal structures, thermal ellipsoid References: ABSEN Entered: Wed May 13 9:46:Īpplication fields: Structure determination.īibliography: P. Release notes were unavailable when this listing was updated.Application fields: Structure, Structure determination.ĭescription: absorption correction for cylinders (very handy for.Take advantage of our unique "Depth Profiling" tool, to rapidly scan ares of interest in massive structures - ideal for characterizing the results from computer models. CrystalMaker X can also handle truly massive structures. CrystalMaker can handle including multi-structure files such as DL_POLY HISTORY - use CrystalMaker's synchronization and animation capabilities to rapidly understand structural behaviour, lattice dynamics, or visualize the trajectory of a simulation. Whilst the built-in libraries are great for teaching, researchers will want to visualize their own data - and they can! CrystalMaker X lets you import data from over 40 different formats: with instant display and powerful customization. This isn't just a static library: you can add your own content, grouping structures into folders and taking advantage of CrystalMaker's powerful search capabilities: search by filename, notes or chemical formula. You can browse structures in the Library's Browser view: grouping by folder, or flat view or simply exploring rotating structures and their notes in the Library's integrated "CrystalViewer". You can add an of these structures to an existing document window, for you to edit or share with colleagues and students. You can use these files as teaching resources: just open the file, hit the Play button, and discover a whole new world of nano-scale beauty. #Crystaldiffract file types full#Many crystal files include multiple structure views, to showcase different aspects of the structure (e.g., a complex framework broken down into its consistuent building blocks, such as (Al,Si)O4 tetrahedra, rings of tetrahedra, cages, channels and building up a full network. These aren't your typical crude CIF text files! All files are saved using CrystalMaker's rich naixava document format (CMDX or CMDF) which lets you instantly load a fully-completed model with bonding, polyhedra, detailed notes (with publication data in most cases) and full metadata for powerful searching.Įach structure has been carefully constructed, with the optimum view direction and model settings to convey the best-possible visual understanding - and thereby saving you valuable time. #Crystaldiffract file types plus#Also included is a teaching library of crystal-chemical type structures, plus thematic libraries covering topics as diverse as chemical warfare, medicinal chemistry, food flavourings and more. The library includes over 400 minerals (all the the major rock-forming minerals plus many more), as well as important inorganic and organic crystals and molecules: from buckyballs to zeolites, and from dental ceramics to high-Tc superconductors. Integrated Structures Library - Now Add Your OwnĬrystalMaker X includes an integrated structures library with some 1200 structures: annotated, indexed and with previews - ready for immediate display. Multiple View "bookmarks" and undo levels encourage exploration and discovery - ideal for teaching and research. Manipulate structures in real time, with the mouse. Energy-modelling tools let you design and relax new structures, predict their vibrational properties, and explore how they interface with other materials.ĬrystalMaker provides a streamlined workflow that majors on productivity: just drag-and-drop your data files into the program for instant display in spectacular photo-realistic colour. CrystalMaker transcends traditional crystallography software, letting you create dynamical visualizations with rotatable animations. Its interactive design lets you "see the wood for the trees" and build your own visual understanding of complex materials. CrystalMaker X is the most-efficient way to visualize crystal and molecular structures.
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