[gmx-users] pdb file of a crystal lattice of epoxy resin
Mark.Abraham at anu.edu.au
Fri Jul 13 03:08:00 CEST 2007
vijay kumar wrote:
> can any one send me a format of pdb file of epoxy
> resin,i want to simulate just epoxy resin crystal
> lattice cubic box size of 12 am and distance between
> each cube is 6 am using boundary temperature
> pdb file of epoxy resin CH2CHO (cubic structure) total
> of 8 lattices
> if possible topology file and steps for the simulation
> without any solvent just analyze the cubic box of lattice
So you just want us to do your whole project for you?
Good luck finding a structure - I'd try googling for one, or emailing
people who you actually know have done such a simulation.
Developing your topology and simulation protocol is your job.
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