[gmx-users] FEP : separating components of dgdl

BON Michael michael.bon at cea.fr
Mon Jan 28 16:44:35 CET 2008


I would like to know if there is a way to see the values of each components (angles, dihedrals, Coulomb...) of dgdl when performing FEP, to check whether I correctly defined the topology of state B. 

Many thanks,
Michael Bon
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