Hi,
How to write your hdb block is described in chapter 5.6.4 of
gromacs-4.5.3 manual
On Mon, 14 Mar 2011 11:58:17 +0200, Yulian Gavrilov wrote:
Dear gromacs users,
Please, can you explain the structure of FFAMBER99.HDB file
For example,
LYN 7
1 1 H N -C CA
1 5 HA CA N CB C
2 6 HB CB CA CG
2 6 HG CG CB CD
2 6 HD CD CG CE
2 6 HE CE CD NZ
2 3 HZ NZ CE CD
Sincerely,
Yulian Gavrilov
--
Best Regards,
Alexey 'Alexxy' Shvetsov
Petersburg Nuclear Physics Institute, Russia
Department of Molecular and Radiation Biophysics
Gentoo Team Ru
Gentoo Linux Dev
mailto:[email protected]
mailto:[email protected]
mailto:[email protected]
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