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#37648 - 09/05/19 11:09 AM trimethyl-lysine parameters
pokorna Offline
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Registered: 09/05/19
Posts: 2
Hi all,

is any of you aware of some existing parameters for simulating trimethyllysine with C36m?

Many thanks,
Pavlina

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#37649 - 09/05/19 11:18 AM Re: trimethyl-lysine parameters [Re: pokorna]
rmv Online   content

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Registered: 09/17/03
Posts: 8379
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No, but if I had to do so I would make a new residue (or patch) using the choline moeity from the lipid force field as a model.
_________________________
Rick Venable
computational chemist


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#37657 - 09/17/19 05:43 AM Re: trimethyl-lysine parameters [Re: pokorna]
pokorna Offline
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Registered: 09/05/19
Posts: 2
Thanks for the hint and reply.
Pavlina

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