Hello OpenBabel users, According to "obabel -L conformer" there is an option that will carry out an exhaustive systematic search for the lowest energy conformer. When I execute "obabel --conformer --systematic", my output structure is identical to the input structure. For example:
$ obabel in.xyz -O out.xyz --conformer --systematic 1 molecule converted $ diff in.xyz out.xyz 2c2 < --- > in.xyz Am I executing the program incorrectly? Best, Eric
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