Re:Schrödinger: The Nvidia biotech partner Jensen Huang told...
by nijuashi on Saturday January 25, 2025 @05:17PM
(#42825464)
The company is an established leader in molecular design software suite. Everyone uses their docking software.
Re:Schrödinger: The Nvidia biotech partner Jensen Huang told...
by nixpulvis on Saturday January 25, 2025 @07:50PM
(#42826591)
TIL Docking: https://en.m.wikipedia.org/wiki/Docking_(molecular)
Re:Schrödinger: The Nvidia biotech partner Jensen Huang told...
by the__alchemist on Saturday January 25, 2025 @10:09PM
(#42827359)
There is also another definition you may or may not find as interesting!
Re:Schrödinger: The Nvidia biotech partner Jensen Huang told...
by colingauvin on Saturday January 25, 2025 @09:43PM
(#42827235)
Not remotely, Schrödinger is well established and basically leads the commoditized computational chemistry market. In fact, there are very many companies that would love to find a cheaper alternative to Schrödinger tools, but no alternatives are performant enough.
Re:Schrödinger: The Nvidia biotech partner Jensen Huang told...
by colingauvin on Sunday January 26, 2025 @03:12PM
(#42833579)
Interesting, but doesn't really overlap with Glide docking at all.
Re:Schrödinger: The Nvidia biotech partner Jensen Huang told...
by esqudo on Sunday January 26, 2025 @05:07PM
(#42834683)
Ligand-receptor docking is one of the many additional modules ModelMole does as part of the custom pipelines, along with things like pH constant, thermal stability and more. I know as I'm one of the directors, happy to talk more if you're interested.
Re:Schrödinger: The Nvidia biotech partner Jensen Huang told...
by colingauvin on Tuesday January 28, 2025 @05:15PM
(#42858787)
Interesting. Couple questions:
Why only mention peptides?
Does it work on membrane proteins?
How do performance and cost compare to Glide? Or Vina? (Performance anyways)
My email is firstname.last names superluminalrx.com
Re:Schrödinger: The Nvidia biotech partner Jensen Huang told...
by wasabi991011 on Sunday January 26, 2025 @02:26AM
(#42828426)
Are you implying that quantum mechanics is not that important to medicine and material design?
So like Theranos? But with all the latest marketing buzzwords.