cxcalc name java.lang.NullPointerException

Hi,

I did a clean install of jchem-5_2_01_1-windows_with_jre.exe

usiing cxcalc logp nci1000.sdf works, but the cxcalc name command fails

Tobias

C:\Program Files\ChemAxon\JChem\examples\molecules>cxcalc name nci1000.sdf
Exception in thread "main" java.lang.NullPointerException
at chemaxon.marvin.plugin.CalculatorPlugin.getResultDomain(CalculatorPlugin.java:1293)
at chemaxon.marvin.plugin.CalculatorPlugin.canRepeat(CalculatorPlugin.java:1120)
at chemaxon.marvin.Calculator$CalculatorInputProducer.<init>(Calculator.java:181)
at chemaxon.marvin.Calculator.run(Calculator.java:1114)
at chemaxon.marvin.Calculator.run(Calculator.java:1096)
at chemaxon.marvin.Calculator.main(Calculator.java:1660)

Hi,

We fixed this bug, the fix will be available in Marvin 5.2.2. Thanks for reporting.

Workaround for Marvin 5.2.1.1:

Use the "-s" (single mode) switch.

$ cxcalc -s name nci1000.sdf

Sorry for the inconvenience.

Zsolt