Willighagen, Egon (BIGCAT) · @egonw
166 followers · 1 posts · Server social.edu.nl

this is my conference tooting account. My regular account is scholar.social/egonw

I am a chemist working in biology on the domains of and (currently) on questions in the fields of , , and I strongly support

#introduction #cheminformatics #bioinformatics #drugdiscovery #metabolomics #toxicology #openscience

Last updated 1 year ago

Nati Labadie (she/her) · @natilabadie
212 followers · 63 posts · Server masto.ai

Hey everyone! Quick here: I'm Nati, a chemist finishing her PhD in Argentina. I mainly work on and but also teach at the national university of rosario. Huge nerd for everything and related, as well as and , but interested in in general.
Also a vegan acrobat shifting from one hobby to another accompanied by my kira.

#introduction #orgchem #compchem #statistics #ai #datasci #cheminformatics #rstats #python #science #cat

Last updated 2 years ago

Daniel Probst · @skepteis
992 followers · 129 posts · Server skepteis.social

Hey and researchers who made the move over here. I created this list which should make it easy to network here. Let me know if you want to be added.
cheminformatics.netlify.app

Alternatively, just open a PR here: github.com/daenuprobst/Mastodo

#cheminformatics #ComputationalChemistry

Last updated 2 years ago

2877133136 · @2877133136
1 followers · 13801 posts · Server 285936586.masto.host

We foster an environment where Atoms are able to break through boundaries. ⚛️ Check out our open roles and join our , , , , and business teams ➡️ atomwise.com/positions/ twitter.com/AtomwiseInc/status

#biotech #pharma #hiring #cheminformatics #medchem #machinelearning #SWE

Last updated 3 years ago

2877133136 · @2877133136
1 followers · 13801 posts · Server 285936586.masto.host

Our newest and research is now out. We show how to use equivariant graph neural networks to predict multiploles, circumventing the need for expensive QM computations. pubs.acs.org/doi/10.1021/acs.j twitter.com/rinikerlab/status/

#compchem #OpenAccess #cheminformatics #ML

Last updated 3 years ago

2877133136 · @2877133136
1 followers · 13801 posts · Server 285936586.masto.host
2877133136 · @2877133136
1 followers · 13801 posts · Server 285936586.masto.host

Digital Sciences for Drug Discovery - A Berlin Seminar Series First event 9 Sep 2021, with @MoAlQuraishi on AlphaFold2 and @wpwalters on ML in Drug Discovery On Zoom, free, open to all - go to digidrug.net/ and share! twitter.com/AndreasBenderUK/st

#machinelearning #drugdiscovery #cheminformatics

Last updated 3 years ago