[Users-list] energy & GLUE

Antonio Carrieri carrieri at farmchim.uniba.it
Wed Sep 6 11:30:51 CEST 2006


I'd like to know if it is possibile to list the different contributions
(i.e. steric contacts, ligand-target Enthalpic interaction energy, water
bridges between ligand and target, hydrophobic interactions, etc) rather
than the overall energy of binding calculated by GLUE dockings
Ciao
Antonio 




More information about the users-list mailing list