@rdkbio.bsky.social
🧬 Structural Bioinformatics | 💊 AI/ML for Drug Discovery | Geometric DL 🔬 @iocbprague.bsky.social, prev. PhD @cusbg.bsky.social @mff.unikarlova.cuni.cz
@jmtomczak.bsky.social
Group Leader, Generative AI | NeurIPS 2024 Program Chair | Principal Scientist & Director | Founder of Amsterdam AI Solutions
@jdijkman.bsky.social
Infusing statistical physics with machine learning to describe molecular fluids. PhD Candidate at UvA with Max Welling, Jan-Willem van de Meent and Bernd Ensing.
@bearnshaw.bsky.social
Father, husband, human, founding fellow @recursionpharma, scientific director @valencelabs, adjunct professor & senior fellow @UUtah
@alvascience.bsky.social
Software Solutions for Cheminformatics and QSAR https://www.alvascience.com/ #QSAR #cheminformatics #machinelearning #moleculardescriptors #compchem
@gklambauer.bsky.social
Deep Learning researcher | professor for Artificial Intelligence in Life Sciences | inventor of self-normalizing neural networks | ELLIS program Director
@20questions.one
Co-founder of Exscientia, now free agent at 20Questions Ltd. | AI drug design | Cheminformatics | active learning | mentoring | innovation
@bengioe.bsky.social
Staff ML Scientist @valenceai.bsky.social Labs/Recursion Pharma, Mila GFlowNets, molecules & stuff https://folinoid.com
@kevinpgreenman.bsky.social
🤖 AI for Science 🌟☧ Asst Prof. @CathInstTech | 🎓 Ph.D. @mitcheme.bsky.social ’24 (@rgblabmit.bsky.social) | 💊💻 Ex: @msftresearch.bsky.social & @elilillyandcompany.bsky.social & Chemprop maintainer | www.kevinpgreenman.com
@maziarz.bsky.social
Principal Researcher at Microsoft Research AI for Science, ML for Drug Discovery, ex Google AI & tensorflight
@xuhuihuangchem.bsky.social
Hirschfelder Chair, Professor of Chemistry, University of Wisconsin-Madison, Director, Theoretical Chemistry Institute, Theoretical chemistry and Biophysics, previously at HKUST, https://huang.chem.wisc.edu/
@dom-beaini.bsky.social
Research Lead at @valenceai.bsky.social, Adjunct prof at @UMontreal and @Mila_quebec, interested in AI, deep learning, drug discovery, graphs, geometry, biology, chemistry, physics, philosophy, and the origin of life 🧠🦠 Aims to become a crazy scientist 👨🔬
@danielzuegner.bsky.social
Senior Researcher @msftresearch.bsky.social #AI for #Science. Past: PhD @ TUM, internships @ Amazon AWS, Spotify. Amateur Photographer in my free time.
@felix-s-k.bsky.social
Assistant Professor of Digital Chemistry (@uni-wuppertal.bsky.social) – building digital tools for synthesis and catalysis. Former: U Toronto (Postdoc) | U Münster (PhD) | MIT (Visiting Researcher) https://fsk-lab.github.io
@moalquraishi.bsky.social
MLing biomolecules en route to structural systems biology. Asst Prof of Systems Biology @Columbia. Prev. @Harvard SysBio; @Stanford Genetics, Stats.
@lucanaef.bsky.social
Co-Founder & CTO, @vant_ai Forbes 30u30 but won't go to jail | prev. ETH Zurich Stanford McKinsey AI x Bio/Chem. vi/vim
@lindorfflarsen.bsky.social
Protein and coffee lover, father of two, professor of biophysics and sudo scientist at the Linderstrøm-Lang Centre for Protein Science, University of Copenhagen 🇩🇰
@invemichele.bsky.social
Computational physicist at https://peptone.io PhD @GroupParrinello, PostDoc @franknoe.bsky.social Disordered Proteins, AI for Science, Molecular Dynamics, Enhanced Sampling 🔗 https://scholar.google.com/citations?user=fnJktPAAAAAJ
@gabegomes.bsky.social
autonomous science & digital molecular designer | assistant professor @cmu with @gpggrp.bsky.social | https://gpggrp.com | https://aithera.ai | h(e/im), views my own
@angelofrei.bsky.social
Medicinal Inorganic Chemistry Group Leader SNSF Ambizione Fellow 2024- Lecturer in Chemistry, University of York (UK) Dog Dad, Space Nerd, DnD Enthusiast
@cmaddis.bsky.social
Asst. Prof. in Machine Learning at UofT. #LongCOVID patient. https://www.cs.toronto.edu/~cmaddis/
@mmbronstein.bsky.social
DeepMind Professor of AI @Oxford Scientific Director @Aithyra Chief Scientist @VantAI ML Lead @ProjectCETI geometric deep learning, graph neural networks, generative models, molecular design, proteins, bio AI, 🐎 🎶
@marwinsegler.bsky.social
Machine Learning, {Org, Med, Comp} Chem, RL/Planning, AI-assisted Scientific Discovery & Creativity, Music. ELLIS Scholar. Team Lead at Microsoft Research AI for Science. 2xDad
@skepteis.bsky.social
Computer scientist, Bioinformatician, PhD in Chemistry and Molecular Sciences. Working on the above as an Assistant Prof at WUR. Interested in all the sciences. Materialist. Fan of cats, Punk Rock, and Hockey.
@jchodera.bsky.social
Achira | http://achira.ai Research laboratory | http://choderalab.org Antiviral drug discovery for pandemics | http://asapdiscovery.org OpenADMET | http://openadmet.org Employer-mandated disclaimer: http://choderalab.org/disclaimer Pronouns: he/him
@aspuru.bsky.social
Professor of Chemistry and Computer Science University of Toronto Faculty member, Vector Institute Director, Acceleration Consortium Senior Director of Quantum Chemistry NVIDIA My views expressed here are personal and are not those of my employers.
@peonor.bsky.social
Chemist, husband, father, singer. Sustainability, catalysis, stereochemistry, predictive modeling. Senior Principal Scientist @astrazeneca.bsky.social Gothenburg. he/him
@olexandr.bsky.social
Chemistry professor at CMU. Connecting chemical sciences with AI #MachineLearning and automated experimentation. #tarheels fan. Care: #design, #photography #Ukraine #cats🐈 Rants are mine
@martinvoegele.bsky.social
Computational Biophysicist, Amateur Photographer, History+Language Nerd. All views my own. Website: https://martinvoegele.github.io/
@andrewrosen.bsky.social
Assistant Professor at Princeton. Quantum-chemical engineer and materials designer. https://rosen.cbe.princeton.edu
@chhdellago.bsky.social
Physicist, professor @univie.ac.at, director of @esivienna.bsky.social, computational physics, statistical mechanics, machine learning, soft matter, biking, hiking, skiing, *320 ppm. 🇪🇺
@jelfschem.bsky.social
Professor in Computational Materials Chemistry at Imperial College (she/her).
@jppiquem.bsky.social
Professor of Theoretical Chemistry @sorbonne-universite.fr & Head @lct-umr7616.bsky.social| Co-Founder & CSO @qubit-pharma.bsky.social| FRSC (My Views) #compchem #HPC #quantumcomputing #machinelearning | https://piquemalresearch.com | https://tinker-hp.org
@pwk2024.bsky.social
Slayer of soucouyants but terrified of douens, centipedes and ceiling fans Blog (Molecular Design): https://fbdd-lit.blogspot.com/
@geoffhutchison.net
Chemist, Scientist, Husband, Dad, Runner, Teacher. I develop Avogadro + OpenBabel to find new materials for energy applications @Pitt_Chemistry he/him
@zwijcompchem.bsky.social
Engineer pretending to be a Computational Chemist working on how light and stuff interact at University College London - husband of @jelfschem.bsky.social - all views are my own 🇳🇱🇪🇺🇬🇧
@anunesalves.bsky.social
Computational biochemist (ligand binding kinetics, crowding) Junior group leader at the Technical University Berlin Associate editor at the Journal of Chemical Information and Modeling Brazilian in Germany
@pschwllr.bsky.social
Assistant Professor at EPFL, ML/AI-accelerated Chemistry & Synthesis | Educating the next generation of chemists and leading a fantastic team (https://schwallergroup.github.io) | Previously IBM Research / Uni Bern / Uni Cambridge / EPFL | he/his
@vlderinger.bsky.social
Computational chemist, curious about the atomic-scale structure of materials & ML for chemistry. Associate Professor at the University of Oxford
@grimmelab.bsky.social
Development and application of efficient computational chemistry methods - based @unibonn.bsky.social. This account is managed by group members of Prof. Stefan Grimme.
@guillemsimeon.bsky.social
(He/him) Physicist. Machine learning and atoms @ Microsoft Quantum. Barcelona. 🏳️🌈
@christophjacob.eu
Professor for Theoretical Chemistry at TU Braunschweig http://www.christophjacob.eu
@gjpvwesten.bsky.social
KNCV Gold Medal 2023. Exploring drug space with AI 💪, Professor of AI & Med Chem in Leiden, Computational Drug Discovery, http://cddl.nl, Opinions are my own.