Noting that the stack indicates nonbonded adjustment as part of ewald
force calculation (likely as not), have you looked for any warnings or
odd energies in your output file prior to this event?
Bill
On 5/22/17 12:54 AM, Nikita Devnarain wrote:
> Dear AMBER users
>
> I'm trying to minimise a complex with a receptor and 2 ligands, however, I
> keep encountering the following error causing termination of the job:
>
> Program received signal SIGSEGV: Segmentation fault - invalid memory
> reference.
>
> Backtrace for this error:
> #0 0x2AAAAC453BF7
> #1 0x2AAAAC452DF0
> #2 0x2AAAAD10124F
> #3 0x56C339 in nb_adjust_
> #4 0x56E268 in ewald_force_
> #5 0x7AAF93 in force_
> #6 0x4E3712 in sander_
> #7 0x4D93A6 in MAIN__ at multisander.F90:?
>
>
> Could anyone assist me with what has been causing this?
>
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Received on Mon May 22 2017 - 01:30:03 PDT
