[gmx-users] (no subject)

saranya saranyahoney17 at gmail.com
Fri Oct 27 11:51:23 CEST 2017


Dear Users,
I have done a simulation of Aggregated amyloid beta peptide for 100ns. The
pdb structure choosen for my work is 1IYT, which has several (10) model
structures, but i have choosen only 4 structure for my simulation. The
problem is after production, if i check the final .gro files of md instead
of 4 peptide structure i got only a single peptide structure. What is the
reason for getting this result?


With Regards,

*Saranya Vasudevan,*

*Research Scholar,*

*Molecular Quantum Mechanics Laboratory,*

*Department of Physics,*

*Bharathiar University,*

*Coimbatore-46*


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