Hi Jean-Luc,
Doug Juers wrote a program for this called MAP_CHANNELS, see
http://scripts.iucr.org/cgi-bin/paper?S160057671402281X
Cheers, Matt
On 2019-05-11 09:39, ferrer wrote:
Dear all,
I am looking for a software to measure channels diameter and larger
volumes along these channels in a crystal packing (not inside the
protein). In previous discussions of the CCP4BB I found many
suggestions for analysis of channels and tunnels inside a protein,
that helps to evaluate ligand accessibility, but not regarding solvent
volume between the molecules in the crystal arrangement. Any
suggestion ?
Regards
JL
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Jean-Luc Ferrer
Institut de Biologie Structurale
71 Avenue des Martyrs
CS 10090
38044 Grenoble Cedex 9 - FRANCE
Ph.: +33 (0)4 57 42 85 22
Cell: +33 (0)6 89 45 13 57
email: [email protected]
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