[gmx-users] fullerene crashes during energy minimization

[Rahul verma]

Dear Gmx Users,

I obtained topology files for fullerene from ATB website in order to
simulate
water confined in fullerene.However on energy  minimization the fullerene
undergoes
complete structural changes.How should I take this up so that the structure
of fullerene
remains same during energy minimization and further steps.

Regards
Rahul