On 03/01/2012 16:29, Cyberbroker1 wrote: > > the -m option works good, but is there anypossibility to make the filename > the molecule name?
There have been several requests for this, so I have added this capability. It is currently only in the development code, and is described a little more on the Openbabel-Devel mailing list. Chris ------------------------------------------------------------------------------ Ridiculously easy VDI. With Citrix VDI-in-a-Box, you don't need a complex infrastructure or vast IT resources to deliver seamless, secure access to virtual desktops. With this all-in-one solution, easily deploy virtual desktops for less than the cost of PCs and save 60% on VDI infrastructure costs. Try it free! http://p.sf.net/sfu/Citrix-VDIinabox _______________________________________________ OpenBabel-discuss mailing list OpenBabel-discuss@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/openbabel-discuss
