Dear Users !
I have done a minimization for a tetrapeptide in a water box
with conjugate gradient minimization of 1000 steps
when I convert it to pdb as below
trjconv -f em.trr -o min.pdb -s em.tpr EOF
0
EOF
the out put pdb has many structures
as
Dear Users !
I have done a minimization for a tetrapeptide in a water box
with conjugate gradient minimization of 1000 steps
when I convert it to pdb as below
trjconv -f em.trr -o min.pdb -s em.tpr EOF
0
EOF
the out put pdb has many structures
as
On 03/04/12, balaji nagarajan balaji_se...@hotmail.com wrote:
Dear Users !
I have done a minimization for a tetrapeptide in a water box
with conjugate gradient minimization of 1000 steps
when I convert it to pdb as below
trjconv -f em.trr -o min.pdb
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