Jmol 11.7.45

• Bug fix: load trajectory XXX.cif not applying fractional coordinates.
• Bug fix: load trajectory {0 -1 1} not loading any models if first model has 0 atoms (as in certain cif files)
• Bug fix: dipole offsetside not working for molecular dipole (EVER!)
• code: refactored scriptEvaluator and Jmol.java. Now it is much simpler to create a truly "headless" Jmol application, where Jmol is being used for the investigation of the structure instead of visualization.
• New application: JmolFrameless.jar: This application completely disallows any display -- it is totally formless. There are no Java Swing JFrames involved, no dialogs, no popup menus, no display of any kind.
• Script editor behaving properly except for a nasty SWING bug that will require recasting this in AWT instead of SWING. See http://bugs.sun.com/bugdatabase/view_bug.do?bug_id=4353673
• New feature: gamessUS reader now reads dipoles and partial charges.
• TODO script editor -- search? argh... I knew this would be a can of worms... script editor -- undo/redo works (CTRL-Z, then SHIFT-CTRL-Z or CTRL-Y)
• New feature: drag/drop and file menu-open scripts directly into editor, from where they can be checked or tested.
• Code: refactored readers, allowing for more obvious initialization/finalization methods
• New feature: App and applet consoles now have "editor" buttons that load scripts into a "script editor" and allow stepping through scripts (and changing values during the pauses) - preliminary only opens a rough draft ScriptEditor
• New feature: Gamess file reader now translates internal basis set and calculation methods representations into roughly literature standard for Pople & Dunning basis sets as well as perturbation, CI and CC calculation methods. This is dumped to calculationType.
• New feature: application console buttons: PAUSE, ?, STEP
• New feature: SHOW TRACE -- reports stack trace
• Bug fix: functions with names starting with _ were local instead of global
• Bug fix: 2 pixels off in y for labels. Dont know why I thought that was necessary in Text.java:setBoxXY.
• New feature: SHOW VARIABLES now gives variable trace through function stack
• New feature: [Oh, VERY COOL!] You can now pause the app anywhere in a script, do anything you want -- even within functions -- change variables, set parameters, anything -- and then resume with RESUME. Some of us have dreamt of having this with JavaScript. Very very useful!
• Bug fix: problems with PAUSE/RESUME within App
• Bug fix: "set ?" nonfunctional
• Bug fix: unmatched { in quotes in @{ } not properly treated: echo @{" testing}"}
• New feature: strings may start with or ", like JavaScript
• New feature: print getProperty("PDBInfo","REMARK300")

Requirements: Mac OS X 10.3 or later.