Dear all, I get an error when trying to set up the MMFF94 forcefield with the following molecule:
B(CP(C(C)(C)C)C(C)(C)C)(CP(C(C)(C)C)C(C)(C)C)C1=CC=CC=C1 Any ideas why this is happening? Best wishes, Scott -- View this message in context: http://forums.openbabel.org/Cannot-set-up-forcefield-for-this-molecule-tp4656514.html Sent from the General discussion mailing list archive at Nabble.com. ------------------------------------------------------------------------------ See everything from the browser to the database with AppDynamics Get end-to-end visibility with application monitoring from AppDynamics Isolate bottlenecks and diagnose root cause in seconds. Start your free trial of AppDynamics Pro today! http://pubads.g.doubleclick.net/gampad/clk?id=48808831&iu=/4140/ostg.clktrk _______________________________________________ OpenBabel-discuss mailing list OpenBabel-discuss@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/openbabel-discuss