[gmx-users] units of the bonding parameters in the .itp file

[Anton Feenstra]

Andrey V Golovin wrote:

> Dear Aina,
> 
> 
> AQ> could anybody tell me which are the units of ffG43a2bon.itp? for the bond
> AQ> parameters? i mean bg_XX?
> 
> For my first look things looks like :
> #define gb_1        0.1000  1.5700e+07
>                      b (nm)
[...]

It is all in the manual, chapters on Topologies and on Forcefield.


-- 
Groetjes,

Anton
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|  _   _  ___,| K. Anton Feenstra                                     |
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