[gmx-users] Re: Adding small molecule parameters to charmm force field

bharat gupta bharat.85.monu at gmail.com
Fri Feb 18 09:08:37 CET 2011


I have obtained the force field paramter of a small molecule (parameterized
for CHARMM FF) and now I want to ad this to the charmm force field so that i
can use it for simulation . I searched gmx userlist but didn't find any
appropriate thread.. can anybody let me know ??

-- 
Bharat
Ph.D. Candidate
Room No. : 7202A, 2nd Floor
Biomolecular Engineering Laboratory
Division of Chemical Engineering and Polymer Science
Pusan National University
Busan -609735
South Korea
Lab phone no. - +82-51-510-3680, +82-51-583-8343
Mobile no. - 010-5818-3680
E-mail : monu46010 at yahoo.com
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