11.7.20 app
pop-up > Minimize
does nothing and raises an error in the Jmol Java Console:
openFile(C:/Documents and Settings/Angel/Escritorio/pru.mol): 281 ms
ModelSet: haveSymmetry:false haveUnitcells:false
haveFractionalCoord:false
1 model in this collection. Use getProperty "modelInfo" or
getProperty "auxiliaryInfo" to inspect them.
ModelSet: not autobonding; use forceAutobond=true to force automatic
bond creation
minimize: initializing (steps = 100 criterion =
0.0010000000474974513) ...
minimize: using org.jmol.minimize.forcefield.ForceFieldUFF
minimize: forcefield =
org.jmol.minimize.forcefield.forcefield...@e555bd
se minimizarán 7 átomos
minimize: creating bonds...
minimize: setting atom types...
minimize: forcefield =
org.jmol.minimize.forcefield.forcefield...@e555bd
125 force field parameters read
minimize: getting angles...
8 angles
minimize: getting torsions...
4 torsions
127 atom types read from UFF.txt
Exception in thread "MinimizationThread"
java.lang.ClassCastException: java.lang.String cannot be cast to
java.lang.Integer
at org.jmol.viewer.Viewer.notifyMinimizationStatus(Unknown Source)
at org.jmol.minimize.Minimizer.startMinimization(Unknown Source)
at org.jmol.minimize.Minimizer$MinimizationThread.run(Unknown
Source)
>From the script console, "minimize" does nothing and gives no error
11.6.12 app works OK both ways
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