Dear ccp4 community, When I see the (improving) accuracy of docking in generating drug like leads, I see predominantly synthetic compounds used.
It occurred to me that it might be informative to use docking of naturally occurring compounds (amino acids, sugars, lipids, factors etc) to find pockets of interest in structures of cryptic function. So I have two questions: 1) which software does this best, or perhaps makes this easiest? 2) are they good validated examples of this in the literature that you know of? Many thanks in advance for your opinions and insights Andy ######################################################################## To unsubscribe from the CCP4BB list, click the following link: https://www.jiscmail.ac.uk/cgi-bin/WA-JISC.exe?SUBED1=CCP4BB&A=1 This message was issued to members of www.jiscmail.ac.uk/CCP4BB, a mailing list hosted by www.jiscmail.ac.uk, terms & conditions are available at https://www.jiscmail.ac.uk/policyandsecurity/
