Cheers, I'll add this to the commit message. Regards,
Edward On 17 June 2011 10:53, Han Sun <[email protected]> wrote: > Hi, > > because this was a mistake generated by me. In a normal xyz file the second > line is just the molecule name. But for reading the xyz file actually it > does not matter whether it has this 0.00000 or not. But I think since this > is a test xyz file it would be good to remove it so that it looks like a > normal xyz file. > > Best, > Han > > On Jun 17, 2011, at 10:47 AM, Edward d'Auvergne wrote: > >> Hi, >> >> Would you be able to explain why the 0.00000 was removed? >> >> Cheers, >> >> Edward >> >> >> >> On 17 June 2011 10:41, Han Sun <[email protected]> wrote: >>> >>> Follow-up Comment #12, task #7404 (project relax): >>> >>> Modifying test_suite/shared_data/structures/Indol_test.xyz >>> This is Han's patch https://gna.org/task/download.php?file_id=13244 >>> attached >>> to the task >>> http://gna.org/task/?7404. >>> In the test_suite/shared_data/structures/Indol_test.xyz 0.00000 after the >>> molecule name was removed. >>> >>> _______________________________________________________ >>> >>> Reply to this item at: >>> >>> <http://gna.org/task/?7404> >>> >>> _______________________________________________ >>> Message sent via/by Gna! >>> http://gna.org/ >>> >>> > > _______________________________________________ relax (http://nmr-relax.com) This is the relax-devel mailing list [email protected] To unsubscribe from this list, get a password reminder, or change your subscription options, visit the list information page at https://mail.gna.org/listinfo/relax-devel
