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Subject:
Re: SO3 group bond type for GLYCAM in LAMMPS - reg.
From:
Naveen Kumar Vasudevan <[log in to unmask]>
Reply To:
Users of GLYCAM & GLYCAM-Web <[log in to unmask]>
Date:
Thu, 13 Jul 2017 15:34:43 -0400
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No LAMMPS doesn't require specifications for bond order, just requires connectivity information, which I provide via a mol2 file ( it contains bond order). Yes, the partial charges are same it makes sense now, I just wanted to make sure whether the bond types were same or different as per GLYCAM.

Thank you for clarifying my doubt.

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