Re: [AMBER] Gromber failed.

From: Nhai <nhai.qn.gmail.com>
Date: Wed, 2 Nov 2016 21:58:03 -0400

The newest version in AT16 is 2.6.1

Hai

> On Nov 2, 2016, at 9:13 PM, Dd H <ddhecnu.gmail.com> wrote:
>
> I checked the version of parmed using this command: "parmed -v" and it's
> version 2.0.5
>
>
>> On 3 November 2016 at 09:00, Hai Nguyen <nhai.qn.gmail.com> wrote:
>>
>>> On Wed, Nov 2, 2016 at 8:56 PM, Dd H <ddhecnu.gmail.com> wrote:
>>>
>>> Hi Jason,
>>> The system contains a protein, a ligand, water and counter ions, and
>>> AMBER99SB force field and GAFF are used. I think the input files are
>>> ordinary. So I don't know why it failed.
>>>
>>
>> which version you're using? you might want to upgrade to AmberTools16
>>
>> Hai
>>
>>
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Received on Wed Nov 02 2016 - 19:00:02 PDT
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