[AMBER] MD distorted

From: MYRIAN TORRES RICO <myriam.torres.iiq.csic.es>
Date: Mon, 23 Sep 2019 11:41:40 +0200

Dear all,

I have a problem with my MD. I launched MD corresponding to
carbohydrates-protein, these ligands (saccharides) have differents
residues like substituents.
When my MD finished, in some cases, the structure of my ligands is
distorted and I can't measures distances and angles over them.

When I worked with only ligands, and my MD turned out distorted I
launched a second MD called TAR, which it was a MD shorter with
restriction.

In this case, have someone any idea?

Thanks in advance,

Myriam


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Received on Mon Sep 23 2019 - 03:00:01 PDT
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