On Fri, Jul 30, 2010 at 7:49 PM, Tim Vandermeersch <tim.vandermeer...@gmail.com> wrote: > On Sat, Jul 31, 2010 at 1:40 AM, David Lonie <lonieda...@gmail.com> wrote: >> On Fri, Jul 30, 2010 at 1:06 PM, Geoffrey Hutchison <geo...@pitt.edu> wrote: >>> Hans De Winter and Silicos whipped up a 2-page quick reference PDF intended >>> to be printed double-sided on one sheet of paper. They wish to distribute >>> it at EuroQSAR, and I've suggested distributing it at the ACS Boston >>> meeting. >>> >>> Please let us know what you think, and any suggestions for improvement. >> >> I like the look and love the idea. One thing that caught my eye, >> should there be a call to OBForceField::MakeInstance() before >> performing the calculations? I've always had to do this -- am I making >> it too complicated, or do the docs need updating? > > FindForceField returns a singleton instance. MakeInstance can > optionally be used to create a new instances.
Ah, ok. Thanks for the clarification, Tim! Dave ------------------------------------------------------------------------------ The Palm PDK Hot Apps Program offers developers who use the Plug-In Development Kit to bring their C/C++ apps to Palm for a share of $1 Million in cash or HP Products. Visit us here for more details: http://p.sf.net/sfu/dev2dev-palm _______________________________________________ OpenBabel-Devel mailing list OpenBabel-Devel@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/openbabel-devel
