Samik Bhattacharya wrote:
Thank you Justin for the answar. but now how to solve it? where
should i make changes to correct that? pls let me know what to do...
waiting for your answar....
Thank you again..
"CA" is not an alpha-carbon, it is a ffgmx atom type. So, therefore, you have
copies some ffgmx parameters into the ffG53a6nb_lipid.itp that the tutorial
describes, probably from the ";; parameters for lipid-GROMOS interactions" which
the tutorial clearly tells you to delete.
-Justin
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-- ========================================
Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin
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========================================
Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin
========================================
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