Cooty McCootFace
@cootymccootface.bsky.social
Gain of Function: Coot and Moorhen updates.
Is the symmetry problem related to you Github question?
March 19, 2025 at 10:34 AM
Is the symmetry problem related to you Github question?
Just to be clear, I mean this image is freely reproducible - not the Science paper!
March 15, 2025 at 1:11 AM
Just to be clear, I mean this image is freely reproducible - not the Science paper!
Old Coot is still Good Coot! Haha!
March 14, 2025 at 6:37 AM
Old Coot is still Good Coot! Haha!
You've probably got your agenda all sorted, but if you have room for a guest lecture @olibclarke.bsky.social could give you a good Coot seminar.
March 9, 2025 at 10:27 PM
You've probably got your agenda all sorted, but if you have room for a guest lecture @olibclarke.bsky.social could give you a good Coot seminar.
Coot-1 lives in the "coot_py3" directory in a CCP4 distribution.
March 9, 2025 at 10:08 AM
Coot-1 lives in the "coot_py3" directory in a CCP4 distribution.
Coot from Homebrew has been updated!
Yay Yoshitaka Moriwaki!
Yay Yoshitaka Moriwaki!
February 25, 2025 at 10:19 PM
Coot from Homebrew has been updated!
Yay Yoshitaka Moriwaki!
Yay Yoshitaka Moriwaki!
There's still lots of (very dull) work for us to do before we can robustly write modern mmCIF.
February 25, 2025 at 6:46 AM
There's still lots of (very dull) work for us to do before we can robustly write modern mmCIF.
Welcome to the party!
February 25, 2025 at 12:19 AM
Welcome to the party!
QED: Quantifying the chemical beauty of drugs:
pmc.ncbi.nlm.nih.gov/articles/PMC...
pmc.ncbi.nlm.nih.gov/articles/PMC...
Quantifying the chemical beauty of drugs
Druglikeness is a key consideration when selecting compounds during the early stages of drug discovery. However, evaluation of druglikeness in absolute terms does not adequately reflect the whole spec...
pmc.ncbi.nlm.nih.gov
February 6, 2025 at 7:10 AM
QED: Quantifying the chemical beauty of drugs:
pmc.ncbi.nlm.nih.gov/articles/PMC...
pmc.ncbi.nlm.nih.gov/articles/PMC...
(I made a mistake, it's an ASP, not a GLU). A N in a pyridine is an acceptor, the trick is the see that although superficially the types are OC (acceptor) for OD1 and OD2, the side-chain is actually an acid! And hence a donor. The crystal was at pH5.4, which supported protonation of ASP.
February 6, 2025 at 12:12 AM
(I made a mistake, it's an ASP, not a GLU). A N in a pyridine is an acceptor, the trick is the see that although superficially the types are OC (acceptor) for OD1 and OD2, the side-chain is actually an acid! And hence a donor. The crystal was at pH5.4, which supported protonation of ASP.