[gmx-users] In itp file from prodrg, what is C0 and C1 in bonds, angles and dihedrals section

[Justin Lemkul]

On 10/25/14 4:36 PM, fatemeh ramezani wrote:
> Hi Dear gmx-users
> In itp file from prodrg, what is C0 and C1 in bonds, angles and dihedrals section;
>

"C" is for "constant," i.e. whatever parameters are needed for those bonded 
interactions.

-Justin

> [ bonds ]
> ; ai  aj  fu    c0, c1, ...
>
> [ angles ]
> ; ai  aj  ak  fu    c0, c1, ...
>
> [ dihedrals ]
> ; ai  aj  ak  al  fu    c0, c1, m, ...
>
>
>
> Thank you
>
> Fatemeh Ramezani
>

-- 
==================================================

Justin A. Lemkul, Ph.D.
Ruth L. Kirschstein NRSA Postdoctoral Fellow

Department of Pharmaceutical Sciences
School of Pharmacy
Health Sciences Facility II, Room 629
University of Maryland, Baltimore
20 Penn St.
Baltimore, MD 21201

jalemkul at outerbanks.umaryland.edu | (410) 706-7441
http://mackerell.umaryland.edu/~jalemkul

==================================================