Can you post your Perl code? (A short sample would be best.) It should
look something like our example C++ code in the docs:
http://openbabel.org/dev-api/classOpenBabel_1_1OBForceField.shtml#_details
- Noel
On 22 March 2012 21:08, Maciek Wójcikowski mac...@wojcikowski.pl wrote:
Hello everyone,
I used all samples that i could. I also based my coding on samples on
OBForceField class. Here is a part on FF, you can se some parts that are
hashed - this means that I tried to used them, but it didnt help much. Also
ANY other class that I used before was throwing qite nice info if misused
or
Here is a part on FF, you can se some parts that are hashed - this means that
I tried to used them, but it didnt help much. Also ANY other class that I
used before was throwing qite nice info if misused or had bad arguments.
$pFF = Chemistry::OpenBabel::OBForceField::FindForceField(MMFF94);
Hello everyone,
Is anybody here using OB perl bindings to do minimizationof any kind? I'm
trying to set it up, but I'm stuck on one problem - Setup() seams not to
run properly from perl:
No matching function for overloaded 'OBForceField_Setup' at ./
minimizer_rm.pl line 68.
It might be due to
