Good tip - noted.
Thanks Bob!
On 20 June 2013 03:14, Robert Hanson <[email protected]> wrote:
> ps -- you can ZAP full models. That's better than deleting them, because
> although DELETE and ZAP are both irreversible, DELETE doesn't recover an
> memory. So use
>
> zap {2.1}
>
> not
>
> delete 2.1
>
> for best memory management.
>
> Bob
>
>
>
> On Wed, Jun 19, 2013 at 6:19 PM, N David Brown <[email protected]> wrote:
>
>> Thanks Bob :)
>>
>>
>> On 19 June 2013 23:53, Robert Hanson <[email protected]> wrote:
>>
>>> delete atomno=13
>>> delete atomno < 10
>>> delete C27
>>>
>>> just like SELECT
>>>
>>>
>>> On Wed, Jun 19, 2013 at 3:12 PM, N David Brown <[email protected]>wrote:
>>>
>>>> I'd like to remove a single atom by name with zap. Removal of symmetry
>>>> equivalents with the same name is acceptable.
>>>>
>>>> Is there a way to do this?
>>>>
>>>> <http://chemapps.stolaf.edu/jmol/docs/#zap>
>>>> http://chemapps.stolaf.edu/jmol/docs/#zap
>>>>
>>>> Running e.g. zap O13 or zap atomname=C27 will eliminate the entire
>>>> molecule containing the specified atom, as suggested in the docs.
>>>>
>>>> Cheers,
>>>>
>>>> Dave
>>>>
>>>>
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>>>
>>>
>>> --
>>> Robert M. Hanson
>>> Larson-Anderson Professor of Chemistry
>>> St. Olaf College
>>> Northfield, MN
>>> http://www.stolaf.edu/people/hansonr
>>>
>>>
>>> If nature does not answer first what we want,
>>> it is better to take what answer we get.
>>>
>>> -- Josiah Willard Gibbs, Lecture XXX, Monday, February 5, 1900
>>>
>>>
>>
>
>
> --
> Robert M. Hanson
> Larson-Anderson Professor of Chemistry
> St. Olaf College
> Northfield, MN
> http://www.stolaf.edu/people/hansonr
>
>
> If nature does not answer first what we want,
> it is better to take what answer we get.
>
> -- Josiah Willard Gibbs, Lecture XXX, Monday, February 5, 1900
>
>
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