Thanks Nat, this is exactly what I was looking for and it makes perfect sense!
To make this more convenient when one has many unidentified densities of
varying lengths, I've written a little extension for Coot that generates a new
UNL residue with a specified number of carbons, makes restraints
My apologies - there was an error in that script, I forgot to delete prodrg
droppings - this one is better:
menu=coot_menubar_menu(Custom)
def make_alkyl_chain():
def make_alkyl_chain_length_n(n):
smiles_string=int(n)*c
new_molecule_by_smiles_string(smiles_string,smiles_string)
Hi all,
See below and contact Joseph Curtis (joseph.cur...@nist.gov) for more
information.
Kushol
Kushol Gupta, Ph.D.
Research Associate - Van Duyne Group
Department of Biochemistry and Biophysics
Perelman School of Medicine at The University of Pennsylvania
Dear colleagues,
can somebody give me a hint, whether the program AQUARIUS2 or a similar
/ successor program is available somewhere?
Thanks a lot in advance!
Best regards, Guenter
Dear Guenter,
my ixquick search for 'aquarius2 program protein' had a hit at
www.kuhnlab.bmb.msu.edu/publication_papers/pdf/raymerjmb1997.pdf that
mentions aquarius2 and sounds as though their program consolv
(www.kuhnlab.bmb.msu.edu) was a replacement.
Regards,
Tim
On 11/07/2014 06:47 PM,
Hi Tim,
thanks for pointing me to that.
Guenter
Dear Guenter,
my ixquick search for 'aquarius2 program protein' had a hit at
www.kuhnlab.bmb.msu.edu/publication_papers/pdf/raymerjmb1997.pdf that
mentions aquarius2 and sounds as though their program consolv
(www.kuhnlab.bmb.msu.edu) was a
