[gmx-users] Ligand is moving far away after energy minimization
Ms. Aswathy S
aswathys at amritapuri.amrita.edu
Fri Feb 20 04:03:45 CET 2009
Dear Gromacs users,
I am doing the MD of protein ligand complex. When I did the energy minimization of this complex, in the result , the ligand molceule is moving far away from the protein.
What could be the possible reason? can anyone tell me how can i overcome this?
Thanks in advance.
Amrita School of biotechnology
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