Hello, I am wondering what is the status of GAFF in Open Babel? These two pages http://openbabel.org/wiki/Category:Force_Fields and http://openbabel.org/wiki/Molecular_mechanics does not mention it. However I can perform geometry optimization with GAFF in Open Babel, or look for atom types.
Thus I was wondering if the implementation of GAFF is still experimental or is it finished and not yet documented? Thank you Nicolas ------------------------------------------------------------------------------ Monitor 25 network devices or servers for free with OpManager! OpManager is web-based network management software that monitors network devices and physical & virtual servers, alerts via email & sms for fault. Monitor 25 devices for free with no restriction. Download now http://ad.doubleclick.net/ddm/clk/292181274;119417398;o _______________________________________________ OpenBabel-discuss mailing list OpenBabel-discuss@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/openbabel-discuss
