From: <eg...@us...> - 2008-05-03 23:14:18
|
Revision: 10800 http://cdk.svn.sourceforge.net/cdk/?rev=10800&view=rev Author: egonw Date: 2008-05-03 16:14:10 -0700 (Sat, 03 May 2008) Log Message: ----------- Added comment on isotopic mass expected to be set beforehand Modified Paths: -------------- cdk/trunk/src/main/org/openscience/cdk/formula/MolecularFormulaManipulator.java Modified: cdk/trunk/src/main/org/openscience/cdk/formula/MolecularFormulaManipulator.java =================================================================== --- cdk/trunk/src/main/org/openscience/cdk/formula/MolecularFormulaManipulator.java 2008-05-03 23:13:27 UTC (rev 10799) +++ cdk/trunk/src/main/org/openscience/cdk/formula/MolecularFormulaManipulator.java 2008-05-03 23:14:10 UTC (rev 10800) @@ -395,7 +395,8 @@ return formula; } /** - * Get the summed exact mass of all isotopes from an MolecularFormula. + * Get the summed exact mass of all isotopes from an MolecularFormula. It + * assumes isotope masses to be preset. * * @param formula The IMolecularFormula to calculate * @return The summed exact mass of all atoms in this MolecularFormula This was sent by the SourceForge.net collaborative development platform, the world's largest Open Source development site. |