From: <ha...@us...> - 2016-08-22 18:05:31
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Revision: 21219 http://sourceforge.net/p/jmol/code/21219 Author: hansonr Date: 2016-08-22 18:05:28 +0000 (Mon, 22 Aug 2016) Log Message: ----------- Modified Paths: -------------- branches/nbo/Jmol/src/org/jmol/viewer/PropertyManager.java Modified: branches/nbo/Jmol/src/org/jmol/viewer/PropertyManager.java =================================================================== --- branches/nbo/Jmol/src/org/jmol/viewer/PropertyManager.java 2016-08-22 17:03:03 UTC (rev 21218) +++ branches/nbo/Jmol/src/org/jmol/viewer/PropertyManager.java 2016-08-22 18:05:28 UTC (rev 21219) @@ -1108,7 +1108,7 @@ : type.equals("pdb") ? "{selected and not hetero}.label(\"ATOM %5i %-4a%1A%3.3n %1c%4R%1E %8.3x%8.3y%8.3z%6.2Q%6.2b %2e \").lines" + "+{selected and hetero}.label(\"HETATM%5i %-4a%1A%3.3n %1c%4R%1E %8.3x%8.3y%8.3z%6.2Q%6.2b %2e \").lines" : type.equals("xyz") ? "%-2e %10.5x %10.5y %10.5z" - : type.equals("cfi") ? "print 'from Jmol" + Viewer.getJmolVersion() + "\n'+{*}.count + ' ' + {*}.bonds.count + '\n' + {*}.format('%10.0[atomno] %10.0[elemno] %10.4[xyz]') + {*}.bonds.format('%i1 %i2') + '\n' + {*}.bonds.format('%ORDER')" + : type.equals("cfi") ? "print 'from Jmol" + Viewer.getJmolVersion() + "\n'+{selected}.count + ' ' + {selected}.bonds.count + '\n' + {selected}.format('%10.0[atomno] %10.0[elemno] %10.4[xyz]') + {selected}.bonds.format('%i1 %i2') + '\n' + {selected}.bonds.format('%ORDER')" : null); if (exp == null) return getModelExtract(vwr.getAtomBitSet(atomExpression), false, false, This was sent by the SourceForge.net collaborative development platform, the world's largest Open Source development site. |