[gmx-users] Re: polymer duplicate atoms

cqgzc guozhicheng222 at 126.com
Mon Mar 18 02:51:52 CET 2013


I want to construct a polymer chain of F2311 with 112 length. In my pdb file,
residues Fre, Fbg and Fen denote the repeat unit —(CH2-CF2-CF2-CFCl)—
,terminate part (Fbg:the beginning of chain with methyl; Fen: the end of
chain with methyl), respectively. It looks like  CH3-A-B...
A-B-A-B-A-B...-A-B-CH3(A means -CH2-CF2- and B represent -CF2-CFCl-). 
f2311-len112.jpg
<http://gromacs.5086.n6.nabble.com/file/n5006393/f2311-len112.jpg>  



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