On 2/20/20 8:30 AM, Peter Mawanga wrote:
My apologies, this can be achieved easily with the command below:
gmx trjconv -s -f -n
-split -o .
It's even easier. You can just use gmx trjconv -sep (with -b/-e as
needed to define a time interval).
-Justin
On Thu, Feb 20, 2020 at 2:15 P
My apologies, this can be achieved easily with the command below:
gmx trjconv -s -f -n
-split -o .
On Thu, Feb 20, 2020 at 2:15 PM Peter Mawanga
wrote:
> Hello everyone
>
> Is it possible to output different frames of a .trr trajectory as single
> .gro files without supplying an index (.n
Hello everyone
Is it possible to output different frames of a .trr trajectory as single
.gro files without supplying an index (.ndx) file each time?
In VMD this can be achieved with:
set mol [molinfo top]
set sel [atomselect $mol all]
set n [molinfo $mol get numframes]
for {set i 0} {$i < $n} {i
