[gmx-users] protein-SWCNT md simulation
atila.petrosian at gmail.com
Sun Jan 27 06:57:05 CET 2013
Very thanks for your quick reply.
I have another question.
Can I use OPLS-AA force field for both of protein and SWCNT in
simulation of the protein-SWCNT complex in water? On the other hand,
is OPLS-AA a suitable force field for SWCNT simulation?
Other than OPLS-AA, which force fields are suitable for simulation of
the protein-SWCNT complex in water?
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