[apbs-users] Optimize Internal Dielectric of Protein
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Victoria Cheng
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Jul 29, 2016, 12:21:51 PM7/29/16
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to apbs-...@lists.sourceforge.net
Hello,
I am trying to let the internal dielectric of a protein optimize freely instead of setting it to 4. Is there a way to do this? I have tried using the VMD plug in and not specifying an internal dielectric constant, but I usually receive an error about output files missing. Any ideas?
Thanks, Victoria
Nathan Baker
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Jul 30, 2016, 6:24:15 PM7/30/16
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to Victoria Cheng, APBS-USERS mailing list
Hello --
APBS does not currently support a feature like you are describing. Out of curiosity, what property are you trying to optimize?