Dear All,
Do you know what is the unit of kb in ffamber94bon.itp file? I need to
add some missing parameters for my system however I have them in
kcal/mol and it seems that ffamber94 uses another units. For example:
b0 kb
C O2 1 0.12500 548940.8 ; 7,(1986),230; GLU,ASP
//taken from ffamber94bon.itp
C O2 1.250 656,0 (kcal/mol) //JCC, 7, 230, 1986
Thank you in advcance for help!
Regards,
Artur
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