Artificial Intelligence is in urgent need of more refined datasets for drug discovery applications! Here is our contribution, the MISATO dataset: biorxiv.org/content/10.110…

embopress.org/doi/full/10.15… #cell #ai #ArtificialIntelligence

Have you had a chance to use RFdiffusion? We would love to hear about it! Please share your story here or send us an email: [email protected] bakerlab.org/2023/03/30/rf-…

ICYMI: AI tools are designing entirely new proteins that could transform medicine nature.com/articles/d4158…

"From Proteins to Ligands: Decoding Deep Learning Methods for Binding Affinity Prediction" Found that ligand encodings, but not protein encodings, affect affinity prediction outcomes biorxiv.org/content/10.110… github.com/meyresearch/DL…

Immune cells hunting down bacteria. 24/7 battle #biology

Bacteria programmed to respond to human DNA used for AI forensic facial reconstruction rdcu.be/dngWl #synbio #biotech @mit Massachusetts Institute of Technology (MIT)deptofBE

Our research group is seeking a theoretical chemistry postdoc. Retweets are highly welcome! #Postdoc #PostdocJobs #ScienceJobs #theorchem #compchem #machinelearning

nature.com/articles/s4146…

pubs.acs.org/doi/abs/10.102… #machinelearning #chemistry #chemicalreaction #cheminformatics

“The structural landscape of the immunoglobulin fold by large-scale de novo design” 🧶🧬 Explores Ig design using combinations of RFDiffusion, ProteinMPNN, AF2, inpainting, they observe some structural biases for some methods biorxiv.org/content/10.110… github.com/JorgeRoel/beta…

How brain cells communicate: #neuroscience

One PhD and one postdoc position is open in the JuricekLab at UZH Chemistry University of Zurich Universität Zürich If interested, apply by October 30 or spread the word :-) We are excited to welcome new members of our team! Sharing appreciated 🙏 jobs.uzh.ch/offene-stellen… jobs.uzh.ch/offene-stellen…

onlinelibrary.wiley.com/doi/10.1002/an… #DNA #Nano # SynBio

Very happy to announce our software VIAMD for Visual Interactive Analysis of #moleculardynamics in JCIM & JCTC Journals. pubs.acs.org/doi/10.1021/ac… #compchem. VIAMD is available on GitHub github.com/scanberg/viamd

Now Nucleic Acids Res our two back-to-back papers with Mitchell O'Connell lab! Our #chemcomp paper unravels the #RNA-mediated allosteric regulation in #CRISPR-Cas13a and discloses functional mutations. academic.oup.com/nar/advance-ar… Souvik Sinha Pablo Arantes - @pabloarantes.bsky.social Adrian Molina & Amun Patel

pubs.acs.org/doi/full/10.10… BrainPepPass is a machine learning algorithm to predict blood-brain penetrating peptides that could help to develop new drugs and delivery systems to reach the central nervous system #MachineLearning #Peptides #Bioinformatics #DrugDiscovery #brain

Despite the incredible diversity we see between the three domains of life, the structure of RNA polymerase is strikingly similar in all three groups! Instructors, click here to learn more: ow.ly/BHsL50QjoQP #biology #RNA #education #animation #science

SHAPE-inspired RNA structure profiling at single-cell resolution!! Read about it in the paper out today from Jiaxu Wang and Yue Wan. nature.com/articles/s4159…

Structural biases in disordered proteins are prevalent in the cell | Nature Structural & Molecular Biology nature.com/articles/s4159…