Date: Fri, 10 Jan 2025 10:22:20 +0530
Sir, here I am attaching the leap.log file and also the screenshot. Dint
receive any error as such. But warnings present. Also, the new prmtop and
inpcrd file is having no water information. Kindly help.
On Fri, Jan 10, 2025 at 10:10 AM David A Case <david.case.rutgers.edu>
wrote:
> On Fri, Jan 10, 2025, Kankana Bhattacharjee via AMBER wrote:
> >
> >But, it seems lig-solv.prmtop and inpcrd files not
> >correctly generated.
>
> Can you show what error messages you recieved, either on the terminal, or
> in the leap.log file? I know these messages can sometimes be confusing,
> but
> the are often understandable. In any event, just saying "it didn't work"
> doesn't provide enough information for people on the list to be of much
> help.
>
> (Don't try to just give your interpretation of what the errors mean -- cut
> and paste the actual results.)
>
> ....dac
>
>
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
- application/octet-stream attachment: leap.log
(image/jpeg attachment: qm-mm-leap.jpeg)
