Hi,
The code instantiates a Conversion object before searching for
Fingerprint types. Adding an extra OBConversion instantiation did not
change anything.
I have also used 'strace' to follow the problem and I did not find any
error (the openbabel libraries are correctly loaded).
Any hints on how
On Nov 17, 2011, at 1:22 PM, Andrew Dalke wrote:
> # In Open Babel 2.3.0, OBConversion() must be called before trying to
> # find any plugin. This was not needed in earlier releases.
> ob.OBConversion()
There's a patch under discussion that would eliminate this for 2.4. Basically,
we switched f
Hi Jérôme,
> It seems that the fingerprints are not loading like before.
I had a similar problem with OB 2.3 support in chemfp. Here's
the comment from the code:
# In Open Babel 2.3.0, OBConversion() must be called before trying to
# find any plugin. This was not needed in earlier releases.
ob
Hi,
I'm currently working on Mychem, and in particular, the support of Open
Babel 2.3.0. It seems that the fingerprints are not loading like before.
Here is a code example:
[...]
string instring(molecule);
string fpType(type);
istringstream inStream(instring);
char *fpStruct = NULL;
uns
