Hi Ambers,
When I run parallelled sander with the command :
mpirun -np 2 sander -O -i in -o ..
It turns out that
>>unknown flag: -p4pg
>> usage: sander [-O] -i mdin -o mdout -p prmtop -c inpcrd -r restrt
>> [-ref refc -x mdcrd -v mdvel -e mden -idip inpdip -rdip
>>rstdip -mdip mddip -inf mdinfo -radii radii]
I donot understand what is -p4pg .
Could you give me some hints ?
Yuguang
Received on Wed Jun 20 2001 - 07:58:39 PDT
