Initial commit. Restored backup from 2008 SmiLib 2.0 rc2.
With NovAliX bug fix (Pascal Muller of NovAliX, by email on 2012-05-30) in Preprocessor.java and SmiLibTest.java, SmiLib 2.0 rc3.
With M. Karthikeyan feature request for a SmiLibRunner convenience method (more precicly: constructor) to embed SmiLib as a class library in other Java projects. Modifications in SmiLibRunner.java and SmiLibRunnerTest.java and new class SmilesListWriter.java, SmiLib 2.0 rc4.
Added JUnit test SmilesListWriterTest.
Now using correct English singular/plural in message "X compound(s) synthesized in...".
Set this.printToCommandLine = true; to avoid printing messages to stdout in external project mode.
Updated example code in JavaDoc.
Out-commented debug printing to stdout.
Added new constant "twoThreeFourValidReactionSchemeScheme" containing the same as "./testdata/234_valid_reaction_scheme.txt" for convenience.
Speed-up to testSmiLibRunnerList() using a small reaction scheme.
Added testSmiLibRunnerListExample1() and testSmiLibRunnerListExample2 to provide easy example code for copy&paste.
New build.
Updated changelog to version 2.0 rc4.
A list entry of SmilesListWriter now consists of a String[2] with index 0 = ID and index 1 = smiles.
Updated test cases since SmilesListWriter now returns List<String[]> instead of List<String>.
Added comments
Added comments
Modified comment
New website directory for temporary deployment at http://melolab.org/smilib/.
Back up of old SmiLib versions.
New build.
Created MeloLab/EvaBundle from our sources and changed the configuration files.
Merge branch 'master' of github.com:archie18/SmiLib.git

Conflicts:
	nbproject/project.properties
	nbproject/project.xml