Thanks
With Regards
Kavya
On Tue, May 10, 2011 at 5:32 PM, Justin A. Lemkul wrote:
>
>
> Kavyashree M wrote:
>
>> Dear users,
>>
>> I wanted to know when DEFINE = -DFLEXIBLE has to be used.
>> its given in the manual that it has to be used when we require flexible
>> water instead of rigid
Kavyashree M wrote:
Dear users,
I wanted to know when DEFINE = -DFLEXIBLE has to be used.
its given in the manual that it has to be used when we require flexible
water instead of rigid waters, so if I am using tip4p water model and
OPLSAA force field, and i use DFLEXIBLE option in EM and
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