Take a protein structure with waters, replace surface waters with Cu++ and run some very basic MD to optimize distances. Many of the atoms will move since Cu++ will find itself in an 'unfriendly' environment, as always caveat emptor :)
Artem - Cosmic Cats approve of this message On Fri, Jun 16, 2023 at 12:00 AM Veerendra Kumar <vkuma...@amity.edu> wrote: > Dear All, > I want to add about 200 copper ions on protein surface randomly. Is there > any program available to serve the purpose? > > Thank you > Best regards > Veerendra > > Get Outlook for Android <https://aka.ms/ghei36> > > ------------------------------ > > To unsubscribe from the CCP4BB list, click the following link: > https://www.jiscmail.ac.uk/cgi-bin/WA-JISC.exe?SUBED1=CCP4BB&A=1 > ######################################################################## 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/
