and whether the simulation is equilibrium dynamics, but we go flooding...
Good journals do not like to accept applicable simulation studies
based on less than 10 ns trajectories, this is a purely practical
advice/observation.
Vitaly
On Thu, Jul 5, 2012 at 10:06 PM, Ganesh Kamath <gkamath9173.gmail.com> wrote:
> Depends on what you are trying to simulate ......
>
> On Jul 5, 2012 8:56 PM, "Dr. Vitaly V. G. Chaban" <vvchaban.gmail.com>
> wrote:
>>
>> >
>> > Dear Sir/Madam,
>> > What is the typical simulation time to get a reasonable and data for
>> > publications use?
>> > Best regards,
>> > Catherine
>>
>> Catherine -
>>
>> Not any femtosecond more after ergodicity is achieved.
>>
>>
>> Dr. Vitaly V. Chaban, 430 Hutchison Hall
>> Dept. Chemistry, University of Rochester
>> 120 Trustee Road, Rochester, NY 14627-0216
>> THE UNITED STATES OF AMERICA
>>
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Received on Thu Jul 05 2012 - 19:30:03 PDT
