[gmx-users] FES and FE molecule topology

[sonali dhindwal]

Hello All,
Could some one please help me in introducing Fe2+ and FES molecule in protein for simulation studies.
But before starting it, I am not able to generate topology file for the same.
I have tried to use HICUP database and used CNS topology file. but it is still not working.
Please help
Thanks and regards
--
Sonali Dhindwal

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