SingleCrystal 3 化學繪圖分析軟體-資安軟體/研究分析軟體/心理學軟體/新永資訊有限公司

简体中文

SingleCrystal 3 化學繪圖分析軟體

SingleCrystal 3 化學繪圖分析軟體
編號
類別

生化統計分析軟體
介紹

From the classroom to the laboratory to the synchrotron: SingleCrystal is the easiest way to visualize and understand diffraction properties of crystals. SingleCrystal lets you simulate X-ray, neutron and electron diffraction patterns from single crystals, display reciprocal lattice sections and construct stereographic projections of planes or vectors. By combining a simulated pattern with an observed diffraction image, you can auto-index the pattern and determine the orientation of your crystal.
價格

諮詢此產品

推文

產品規格
Cross Platform

Cross Platform

Cross Platform - Done Properly

SingleCrystal is available in two versions, for Windows (include Windows 10), or for Mac OS X (including "High Sierra"). These are genuine, 100% native Windows and Mac applications, built from scratch for their respective operating systems to give you the best-possible system integration, performance, usability - and elegance of design. Mac and Windows versions share the same binary file format, and similar feature sets, making cross-platform working and collaboration easy!

SingleCrystal 化學繪圖分析軟體

Introducing SingleCrystal 3
From the classroom to the laboratory to the synchrotron: SingleCrystal is the easiest way to visualize and understand diffraction properties of crystals. SingleCrystal lets you simulate X-ray, neutron and electron diffraction patterns from single crystals, display reciprocal lattice sections and construct stereographic projections of planes or vectors. By combining a simulated pattern with an observed diffraction image, you can auto-index the pattern and determine the orientation of your crystal.

Interactive Diffraction Simulation
SingleCrystal provides simulation of key diffraction techniques - Laue, Precession & transmission electron diffraction - with control over sample and instrumental parameters. Reciprocal lattice sections can also be visualized, with control over layer height. SingleCrystal 3's multi-core architecture dramatically accelerates simulation times for massive structures such as proteins. Once the intensity calculation is complete, diffraction patterns can be rotated in real time using the mouse or multi-touch gestures on the trackpad. SingleCrystal supports high-resolution "Retina" graphics on the latest iMac and MacBook/Pro computers.

Measure and Explore
SingleCrystal can label reflexions, show systematic absences, and lets you measure distances and angles between diffraction spots. You can colour-code your patterns by intensity, wavelength, or even phase angle. Diffraction- and structural data can be browsed and sorted on screen. You can edit lattice parameters and site occupancies - and opt to exclude certain sites from the diffraction calculation.

Real-Time Multi-Touch Control
SingleCrystal lets you rotate your (virtual) crystal in real time, using multi-touch gestures (Mac), by clicking-and-dragging with the mouse, clicking toolbar "tilt" controls, or using the keyboard. Precise tilts can be entered, or you can define a view direction as a plane normal or lattice vector. Other controls allow you to change the scale (camera constant), saturation, sample thickness, wavelength and other parameters.

Compare Simulated & Observed Data
You can use SingleCrystal as a virtual lightbox: just drag-and-drop a diffraction image into any window, zoom in to examine fine details, move or rotate the image. Use the translucent Ruler, Protractor and Grid overlays to measure your pattern and copy the results to the clipboard. Simulated patterns can be superimposed above observed patterns, for direct comparison. With the Grid tool, auto-indexing is a breeze: just position the grid points over your observed pattern (TEM or Precession photos) and let SingleCrystal calculate the best-fit orientation and index your diffraction spots.

Stereographic Projections
To help you navigate through diffraction space, you can take advantage of a live stereographic projection ("stereogram") which can be displayed on the right-hand side of each diffraction window. The stereogram shows the angular positions of plane normals or lattice vectors (zone axes) plotted as poles and optionally as great circle traces - and is fully customizable. SingleCrystal can even display symmetry-related poles and traces.

Data & Graphics Export
SingleCrystal lets you save your work in a self-contained session file, ready for instant display next time you use the program. You can also export diffraction data listings and "Zone Axes" files - useful for indexing observed patterns. Diffraction patterns (including background pictures and measurements) can be printed at high resolution. You can also copy or export graphics and stereographic projections in either pixel- or vector-based formats.

CrystalMaker X Integration
SingleCrystal 3 is designed to work with CrystalMaker X, reading from saved crystal files to simulate diffraction properties. The two programs can be linked, letting you view a crystal structure in one window, and its diffraction pattern in another. With CrystalMaker's "Live Rotation Mode" enabled, rotating the crystal causes its diffraction pattern to rotate - and vice versa.

COSMOtherm 量子化學軟體

COSMOtherm is the first publicly available and most advanced implementation of the COSMO-RS theory, which was published by A. Klamt at Bayer in 1995. He started COSMOlogic a few years later to focus on the advancement of COSMO-RS and COSMOtherm. COSMOtherm has found widespread use in many industrial branches related to chemistry, pharmaceutics, consumer goods or fragrances.

特價0元原價0元

Diamond 4 分子結構軟體

Diamond是傑出的分子和晶體結構顯示軟體.它結合了多種功能，可以用於含有晶體結構數據的工作，適用於教育，科學研究以及出版。Diamond像其它的軟體一樣不僅可以畫出精密的分子和晶體結構圖片，它還有一系列拓展的功能，它可以讓你很容易的從一套基本結構參數（晶胞，空間群和原子的位置）中模擬任意部分的晶體結構。

特價0元原價0元

CrystalMaker X 化學分子建構軟體

便捷、靈活CrystalMaker能夠容易的載入結構數據並產生壯觀的，相片型的圖形，戴上3D立體眼鏡，還可以感受立體3D畫面，親臨分子結構當中。模型能夠廣泛的設置，顯示個別原子，鍵和多個側面。全面的互動CrystalMaker包括實時操作和編輯、設計新結構的能力，99個undo標準加上多重的、用戶定義的觀點，鼓勵深入的探測和研究，是理想的科研和教學方式

特價0元原價0元