[gmx-users] Help with make_ndx and
Anton Feenstra
feenstra at chem.vu.nl
Mon Feb 25 13:39:00 CET 2002
Peter Ahlström wrote:
>
> Note that the numbering of atoms starts at 0 [as in C-programming loops]
> and not on 1 [as in fortran programming loops] so there is a small
> difference of numbering (at least as I know from gromacs-2.x)
Fortunately, you are not correct ;-)
At least, you used to be correct (in 2.x) but we changed all text-based
input files to number everything from 1 (one), since that makes more
sense to most humans...
--
Groetjes,
Anton
________ ___________________________________________________________
| | Anton Feenstra |
| . | Dept. of Pharmacochemistry - Free University Amsterdam |
| |---- | De Boelelaan 1083 - 1081 HV Amsterdam - The Netherlands |
| |---- | Tel: +31 20 44 47608 - Fax: +31 20 44 47610 |
| ' __ | Feenstra at chem.vu.nl - http://www.chem.vu.nl/afdelingen/FAR|
| / \ |-----------------------------------------------------------|
| ( ) | Dept. of Biophysical Chemistry - University of Groningen |
| \__/ | Nijenborgh 4 - 9747 AG Groningen - The Netherlands |
| __ | Tel +31 50 363 4327 - Fax +31 50 363 4800 |
| / \ | K.A.Feenstra at chem.rug.nl - http://md.chem.rug.nl/~anton |
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