How can I simulate beta peptides?

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Istvan Mandity

Dear Venkat,

We used the MMFF94x force field for the computation of beta-peptides.

Best regards

István

Venkat Reddy Chirasani

Dear Istvan,

Thank you for the quick reply. How can I get this forcefield? Can I import this forcefield to GROMACS?

This question I can not answer. We used the MOE software package for the simulation.

Thank you Istvan. I will try to use MOE software.