[gmx-users] units of bonding parameters in ffG43a2bon.itp
Andrey V Golovin
golovin at genebee.msu.su
Thu Aug 5 18:00:42 CEST 2004
Dear Aina,
Thursday, August 5, 2004, 5:55:09 PM, you wrote:
>> >dear gromacs users,
>> >
>> >could anybody tell me which are the units of ffG43a2bon.itp? for the bond
>> >parameters? i mean gb_XX? B0[N] cannot be given in angsroms!!
>>
>> nm
>>
>> >thank you!
>> >
>> >_______________________________________________
AQ> and CB?
Kj/mol/nm^4
F= Kj/mol/nm = CB*(r^2-b^2)*r
--
Best regards,
Andrey mailto:golovin at genebee.msu.su
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