Can you provide a short script that reproduces the problem? For
example, with SMILES strings.
- Noel
On 26 March 2012 11:28, mwojcikowski wrote:
> I've done some extra testing, when I wanted to write the simplest script to
> recreate that problem. It seams it was my fault, and Setup does work
>
I've wrote short script to replicate that problem.
#!/usr/bin/perl
use Chemistry::OpenBabel;
my $mol1 = new Chemistry::OpenBabel::OBMol;
my $mol2 = new Chemistry::OpenBabel::OBMol;
#my $mol3 = new Chemistry::OpenBabel::OBMol; # should not be necesary
my $obConversion = new Chemistry::OpenBabel: