[AMBER] Amberff14sb

From: Dylan Tasse <catrixs01.hotmail.com>
Date: Tue, 2 Jul 2019 14:52:07 +0000

Hi,

I'm writting to you today because I need some precision about the parameters in Amber ff14SB.

I gave you on this email the supporting information of amberff14SB which discribe the parameters of ff14SB.

On page 8 and page 9, you can see the amino acid PHE and TYR. They say that the bêta carbon "CB" is a atom type of 2C as you can see (I highlighted in red for more clarity).

But in fact, on amberff14sb, it is still an atom type of CT when I compare...

So my question is: Why did they not change the atom type? Is that an error ?

Thank you some much for your time and have a great day

Dylan

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Received on Tue Jul 02 2019 - 08:00:03 PDT
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