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Jmol 12.2 RC 6

Jmol is an applet and Java based application designed to display various 3D chemical information. Jmol’s features include reading a variety of file types and output from quantum chemistry programs, and animation of multi-frame files and computed normal modes from quantum programs · The JmolApplet is a web browser applet that can be integrated into web pages. It is ideal for development of web-based courseware and web-accessible chemical databases. The JmolApplet provides an upgrade path for users of the Chime plug-in. · The Jmol application is a standalone Java application that runs on the desktop. · The JmolViewer can be integrated as a component into other Java applications. · Translated into multiple languages: Catalan (ca), Chinese (both zh_CN and zh_TW) Czech (cs), Dutch (nl), French (fr), German (de), Hungarian (hu), Italian (it), Korean (ko), Portuguese – Brazil (pt_BR), Spanish (es), Turkish (tr), (in addition to the native American English, en-US, and British English, en-GB). · Automatically adopts the language of the user’s operating system, if it is among the translations available. You can change to another language if desired. · Supports all major web browsers: Internet Explorer, Mozilla and Firefox, Safari, Google Chrome, Opera, Konqueror, IceWeasel · High-performance 3D rendering with no hardware requirements · Support for unit cell and symmetry operations · Schematic shapes for secondary structures in biomolecules · Java Runtime Environment · bug fix: load PACKED SUPERCELL produces redundant atoms · new feature: transparent background PNG images with WRITE PNGT xxxx.png · — set ANTIALIASEIMAGES false to avoid slight trim issue · — use an unusual color, such as [x010101] for the background # new feature: preliminary CASTEP .phonon frequency file reader # — preliminary only · — reads q=0 and q#0 points · — use load … SUPERCELL to select out a specific q-point · — for example: load c60.phonon {1 1 1} SUPERCELL {2 1 2} · will select for q = (0.5 0 0.5) # load c60.phonon -5 {1 1 1} SUPERCELL {2 1 2} · and only mode 5 for q = (0.5 0 0.5) · load c60.phonon -5 {2 2 2} SUPERCELL {-4 1 2} · eight supercells; mode 5 only for q=(-0.25 0 0.5) · new feature: unitcell {xxx yyy z} where z is negative fills entire (standard) xxx yyy space with unit cells of size z · bug fix: AtomSetChooser set up too late — can override embedded jmolScript vibration/vector scale commands · bug fix: set naviationPeriodic while navigating should disallow unit ce…

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