Hello, I am running Open Babel 2.3.2.
I naively thought that the command: obabel input.mol2 -O output.mol2 --confab --conf 50 Would give me in output.mol2 the 50 lowest energy conformers of each molecule in input.mol2. Unfortunately not (output.mol2 is equal to input.mol2). What is the proper way to call confab ? Thanks, F. ------------------------------------------------------------------------------ Find and fix application performance issues faster with Applications Manager Applications Manager provides deep performance insights into multiple tiers of your business applications. It resolves application problems quickly and reduces your MTTR. Get your free trial! https://ad.doubleclick.net/ddm/clk/302982198;130105516;z _______________________________________________ OpenBabel-discuss mailing list OpenBabel-discuss@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/openbabel-discuss
