Anthony Nash PhD
@anthonyc1nash.bsky.social
Computational Chemist. Theoretical Biophysicist (physics-based modelling). Protein Dynamics. Unconventional Computing. Metalloproteases.
Absolutely stunning.
September 8, 2025 at 7:10 PM
Absolutely stunning.
Thanks so much. Sounds like I'm after MolecularNodes in Blender :-)
July 5, 2025 at 1:14 PM
Thanks so much. Sounds like I'm after MolecularNodes in Blender :-)
And Python 2.7 on a different package. That's a sackable offense, surely ;-)
May 28, 2025 at 11:53 AM
And Python 2.7 on a different package. That's a sackable offense, surely ;-)
Thanks. MACE-MP-0 has zinc data, but further training would still be required to compensate for changes in the zinc coordination number in the binding pocket relative to my system. Thanks, this is a start.
May 21, 2025 at 12:21 PM
Thanks. MACE-MP-0 has zinc data, but further training would still be required to compensate for changes in the zinc coordination number in the binding pocket relative to my system. Thanks, this is a start.
This looks great. Is it suitable for metalloproteases? Zinc protein binding centres, in particular?
May 21, 2025 at 11:42 AM
This looks great. Is it suitable for metalloproteases? Zinc protein binding centres, in particular?
Agreed. I worked incredibly hard, but my career was derailed twice: Brexit and the Pandemic.
May 21, 2025 at 8:18 AM
Agreed. I worked incredibly hard, but my career was derailed twice: Brexit and the Pandemic.