Hello everyone, I'm trying to become familiar with OpenBabel and playing with it doing all kinds of things I want to do.
When I try to call the function OBRotor::CalcTorsion(coord), it complains segmentation fault. I used gdp debugger to look into it and found that the reason is the array _torsion, which is an attribute of OBRotor class, in function CalcTorsion is empty and is not initialized. Then I searched all kinds of header and cpp files, I don't find anyone in which the array _torsion is initialized. Can anyone give me an hint about what's going on here? Thanks in advance! Xinqiang
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