Christian
Thank you very much.
That is very helpful.
Decai
On Mon, Nov 4, 2019 at 10:57 AM Christian Blau wrote:
> Hello Decai,
>
>
> h2order works in the following way:
>
>- all water molecules are put into the simulation box by applying
> periodic boundary conditions so that the first
>
Hello Decai,
h2order works in the following way:
- all water molecules are put into the simulation box by applying periodic boundary conditions so that the first
water molecule atom is in the simulation box
- the simulation system is sliced along z (0,0,1) direction (default, can be
Hi, All
There are four columns from the output of gmx h2order, mux, muy, myz,
cosine with normal.
What are they? Can anyone further explain?
Decai Yu
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