[gmx-users] martini: what is the column position if "ASP" is changed to "ASP0" in the itp file?

ZHANG Cheng 272699575 at qq.com
Fri Feb 1 14:48:04 CET 2019

Dear Martini users,

I want to change some chargeable residues into neutral forms. e.g. change "ASP" to "ASP0".

If the column is indexed from 1 (not from 0), the "ASP" column positions are 21-23. So, if "ASP0" is used, should their column positions be 20-23 or 21-24 in the itp file?

Thank you!

Yours sincerely

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