Hi GROMACS specialist,
I am using MARTINI forcefield,
My mdp file contain following parameter
constraint_algorithm = Lincs
unconstrained_start = no
lincs_order = 4
lincs_warnangle = 90
gromacs output is
Step 0, time 0 (ps) LINCS WARNING
relative constraint
On 9/03/2012 4:27 PM, rama david wrote:
Hi GROMACS specialist,
I am using MARTINI forcefield,
My mdp file contain following parameter
constraint_algorithm = Lincs
unconstrained_start = no
lincs_order = 4
lincs_warnangle = 90
gromacs output is
Step 0, time 0 (ps)
2 matches
Mail list logo