detecting vanishing atoms in zero.fep

From: soroush ziaei (
Date: Sat Oct 27 2018 - 16:37:20 CDT

hi all,
i want to know how can i detect which atom should be -1 in fep file in
order to obtain correct value for delta<g>?
or please describe some method to generate topology file for a unique
structure, such as topology file that exist in tutorial (

best regards,

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