[gmx-users] Problem with Prdrg with NR5

xmluo xmluo at mail.shcnc.ac.cn
Tue Mar 12 03:26:11 CET 2002

Dear Gromacs users,

I encounter a problem while using Prodrg to make Gromacs top file.
Hydrogen atom attached to nitrogen in the following molecule

|    \
|     N-H
|    /

was deleted, and the nitrogen atom was asigned with type NR5.
Can someone help me? Thanks.

Xiaomin Luo

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