[Chimera-users] Electrostatic potential
George Tzotzos
gtzotzos at me.com
Tue Jun 26 07:00:59 PDT 2012
I have experience with APBS. PyMol has an APBS plugin. You can also use APBS using AutoDock Tools (http://autodock.scripps.edu/resources/adt)
However, I suggest that you visit first the APBS website. There's plenty of information there (http://www.poissonboltzmann.org/apbs/)
Regards
George
On Jun 26, 2012, at 3:48 PM, cantini at cerm.unifi.it wrote:
>
> Regarding these programs
> Do you know how they worked and which are the best? I tried to installed them but without success .
>
> Francesca
>
> sette at uniroma2.it ha scritto:
>
>>
>>
>> Chimera don't make calculations of electrostatic potential.
>> You can use other softwares for this, like APBS or Delphi.
>>
>> Marco
>>
>>
>> George Tzotzos <gtzotzos at me.com> ha scritto:
>>
>>> Hi everybody,
>>>
>>> Assuming that one knows the precise residues constituting a binding site, it is possible to calculate the electrostatic potential of these residues only? If yes, how?
>>>
>>> Thanks for any advice
>>>
>>> George
>>> _______________________________________________
>>> Chimera-users mailing list
>>> Chimera-users at cgl.ucsf.edu
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>>>
>>
>>
>>
>> Dr.Marco Sette, Ph.D.
>>
>> Department of Chemical Sciences and Technology
>> University of Rome, "Tor Vergata"
>> via della Ricerca Scientifica, 00133, Rome, Italy
>> e-mail: sette at uniroma2.it
>> e-mail: m77it at yahoo.it
>> Tel.: +39-0672594424
>> Fax: +39-0672594328
>>
>> www.rete29aprile.it
>>
>>
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