Hello everyone!
I am using the weighted rotor search implemented in Open Babel in order to search for low-energy conformers of a huge molecule. Since the total number of rotamers is of the order 10^16, I cannot explore a decent portion of the search space by running the code serially (I use a python script, which calls the function WeightedRotorSearch). Is it possible to parallelize the optimization of trial conformers on many cores? How to do that properly? Thank you in advance for your help, Michele Galasso
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