ChemBioHub - Huber Lab @chembiohub.bsky.social We are a chemical biology lab at the Nuffield Department of Medicine at the University of Oxford.
www.chembiohub.com
Centre for Medicines Discovery @cmd.ox.ac.uk A multi-disciplinary Institute within the University of Oxford which focuses upon translational activities to catalyse the discovery of new medicines.
Radoslav Krivak @rdkbio.bsky.social 🧬 Structural Bioinformatics | 💊 AI/ML for Drug Discovery | Geometric DL
🔬 @iocbprague.bsky.social, prev. PhD @cusbg.bsky.social @mff.unikarlova.cuni.cz
Marc Reid @reid-indeed.bsky.social 🧪 Senior Lecturer | U. of Strathclyde
📕 Author | “You Are Not a Fraud”
🎤 Host | The reid_indeed Podcast
🎥 CSO | Kineticolor Ltd
https://www.dr-marc-reid.com
https://www.kineticolor.org
Oriana Brea @orianabrean.bsky.social Computational Chemist at Johnson & Johnson Innovative Medicine. Opinions are my own.
#CompChem
@derekvtilborg.bsky.social @derekvtilborg.bsky.social 
Sam "The Mug Guy" Horrell @drhorrell.bsky.social Scientist 🧑🔬, structural biologist 🧬, X-ray Crystallographer 💎, Synchrotron Mug Enthusiast ☕, D&D 🎲 and MTG player 🧙, bird dad to Nori and Kili 🦜🦜
He/Him
Fergus Imrie @fergusimrie.bsky.social Florence Nightingale Bicentenary Fellow, Oxford Statistics | Former Postdoc UCLA, DPhil (PhD) Oxford
https://fimrie.github.io/
Max Bonomi @bonomimax.bsky.social Head of Computational Structural Biology Lab @pasteur.fr. ERC-CoG 2022. Research Director DR2 @cnrs.bsky.social. Founder/developer @plumed.org
Ron Cvek @roncv.bsky.social PhD @ Oxford | Cheminformatics & Computational Chemistry
Leo Klarner @leoklarner.bsky.social 
Oxford Protein Informatics Group (OPIG) @opig.stats.ox.ac.uk Research group led by Charlotte Deane, based in the Department of Statistics at the University of Oxford.
https://opig.stats.ox.ac.uk/
@xchem.bsky.social @xchem.bsky.social 
@dvav.bsky.social @dvav.bsky.social 
FACCTs @faccts.de FACCTs is bringing the ORCA quantum chemistry software to industry - promoting the next Quantum leaps in the Pharma, Materials and Chemical Industries.
Visit us at www.faccts.de
Will Poole @willgpoole.bsky.social Computational chemist interested in designing and using tools for structure based drug design. Free energies are cool
Nicholas Runcie @nicholasruncie.bsky.social AI for drug design | Oxford DPhil student | MChem | RSci | opinions my own
Nele Quast @nele-q.bsky.social Deep learning for Biologics @ Oxford Protein Informatics Group
Semiha K Bali @semihakbali.bsky.social Currently postdoc @LLNL
#CADD #drugdiscovery . Grows 🍅 on the balcony.
@bwcheng.bsky.social @bwcheng.bsky.social 
@ollymcrook.bsky.social @ollymcrook.bsky.social 
Gabriel Abrahams @gabriel-abrahams.bsky.social DPhil student in the Engineered Biotechnology Group, University of Oxford. https://steel.ac/
ORCID: 0000-0002-2360-7150
@edg1983.bsky.social @edg1983.bsky.social 
Sanaz Kazeminia @skazeminia.bsky.social PhD Student at the University of Oxford | Researching AI for Small Molecule Drug Discovery at Oxford Protein Informatics Group ⌬ | GPhC Registered Pharmacist 💊🩹
@mscw.bsky.social @mscw.bsky.social 
Simon Dürr @handle.invalid Assistant Professor UAS at HES-SO Valais-Wallis 🇨🇭 🤗 HF Fellow. Working on AI, Protein Design and Open Science. Creator of bioicons.com
Martin Steinegger 🇺🇦 @martinsteinegger.bsky.social Developing data intensive computational methods • PI @ Seoul National University 🇰🇷 • #FirstGen • he/him • Hauptschüler
James Fraser @fraserlab.com Professor and Chair @UCSF/@UCSF_BTS - dynamic structural biology and open science - (he/him) - fraserlab.com
Syma Khalid @sykhalid.bsky.social Prof of Computational Microbiology. Oxford Biochemistry & St Anne’s College. Bacterial Cell Envelopes. LFC fan 🌈
Kevin K. Yang 楊凱筌 @kevinkaichuang.bsky.social Principal Researcher in BioML at Microsoft Research. He/him/他. 🇹🇼 yangkky.github.io
Martin Vögele @martinvoegele.bsky.social Computational Biophysicist, Amateur Photographer, History+Language Nerd.
All views my own.
Website: https://martinvoegele.github.io/
Christopher Frank @chrisfrank662.bsky.social De novo Protein Designer
DNA Origami wizzard
I like lifting rocks
PhD student
@TU_Muenchen
Phil Biggin @philbiggin.bsky.social Computational biochemist, interested in neuronal signalling at the atomic level and computer-aided drug design. All views my own.
bigginlab.web.ox.ac.uk
Matteo Cagiada @mcagiada.bsky.social 🇮🇹, Computational biophysicist, NNF Postdoc in #OPIG at University of Oxford | previously PhD and PostDoc at University of Copenhagen (KLL group)
Garrett M. Morris @garrettmm.bsky.social Physicochemical deep learning, protein-ligand docking and scoring, computer-aided drug discovery and design, cheminformatics. All views my own. @morrislab@fediscience.org 🏳️🌈🇪🇺
University of Oxford @ox.ac.uk Welcome to our official account 👋 Follow for the latest news, research and updates about life at Oxford.
Department of Statistics @oxfordstatistics.bsky.social We're the Department of Statistics at the University of Oxford (UK). We provide teaching & complete research on computational statistics and statistical methodology, probability, bioinformatics and mathematical genetics.
https://www.stats.ox.ac.uk/
John Chodera @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
Francesca Grisoni @fragrisoni.bsky.social Associate Prof | AI for drug discovery | Eindhoven University of Technology | Previously ETH Zurich & UniMiB | she/her 🏳️🌈
Olexandr Isayev 🇺🇦 🇺🇸 @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
Jan H. Jensen @janhjensen.bsky.social Computational chemist at the University of Copenhagen #compchem
pen(Taka) @iwatobipen.bsky.social Medicinal Chemist, Cheminformatician, Runner and ?
Gerard JP van Westen @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.
Kresten Lindorff-Larsen @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 🇩🇰
Frank Noe @franknoe.bsky.social Scientist, #MachineLearning and #AI for Moleculear Sciences. Scuba Diver. Loves @cecclementi.bsky.social
Drugs for Neglected Diseases initiative (DNDi) @dndi.org International non-profit developing safe, effective, and affordable treatments for the most neglected patients.
Frances Arnold @francesarnold.bsky.social Engineer/scientist, Nobel Prize in Chemistry 2018
I love evolution, enzymes, protein engineering, AI
Linus Pauling Professor at Caltech
Roland Dunbrack 🏳️🌈 @rolanddunbrack.bsky.social Computational structural biologist. Gay, out & proud since 1986. I support transgender & nonbinary people. Video about my LGBTQ+ life in science: https://tinyurl.com/45srzjdw. Views my own, not my employer's.
John Irwin Chemistry @chem4biology.bsky.social We offer tools to find ligands for targets and targets for ligands. More soon.
@ericjdwang.bsky.social @ericjdwang.bsky.social 
ChimeraX @chimerax.ucsf.edu UCSF ChimeraX - software for visualizing biomolecules
David B. Sauer @davidbsauer.bsky.social Membrane Transporters, Ion Channels, Structural Biology, Bioinformatics... and other bits of fun
Purdue BS, UTSW PhD, NYUSoM PostDoc, Univ. of Oxford PI
davidbsauer.com
Brady Johnston @bradyajohnston.bsky.social Scientific animator, structural biologist, creator of #MolecularNodes bradyajohnston.github.io/MolecularNodes/
Protein Society @proteinsociety.bsky.social A global community of researchers dedicated to the understanding of proteins.
Institute for Protein Design @uwproteindesign.bsky.social We create proteins that solve modern challenges in medicine, technology, and sustainability.
• 2024 Nobel Prize in Chemistry
• University of Washington, Seattle
→ ipd.uw.edu
Rosetta Commons @rosettacommons.bsky.social Rosetta Commons is the central hub for hundreds of developers and scientists from ~100 universities and laboratories to contribute and share the Rosetta source code.
Rosetta Commons members develop software improvements to solve their unique queries.
Ajasja💻🧬🔬 @ajasjaljubetic.bsky.social Research Assistant Professor, National Institute of Chemistry, Baker lab @ UW alumni, MSCA alumni. http://ljubetic-lab.si
Sergey Ovchinnikov @sokrypton.org Scientist, Assistant Professor at MIT biology, #FirstGen
Derek Lowe @dereklowe.bsky.social Medicinal chemist / chemical biologist, author of “In the Pipeline” at http://science.org/blogs/pipeline. derekb.lowe@gmail.com and on Signal at Dblowe.18
All opinions are mine; I don’t speak for my employer in any way.
Peter Kenny @pwk2024.bsky.social Slayer of soucouyants but terrified of douens, centipedes and ceiling fans
Blog (Molecular Design): https://fbdd-lit.blogspot.com/
Andreas Bender @andreasbender.bsky.social Cheminformatics, bioinformatics, drug discovery, computational life sciences etc - for more information please see https://andreasbender.de
Proud editor of the 'Cambridge Cheminformatics Newsletter' - please see https://www.drugdiscovery.net 
Pat Walters @wpwalters.bsky.social Cheminformatics, ML, Drug Discovery
Greg Landrum @greglandrum.bsky.social Cheminformatician, developer, climber, runner, hiker, cook
ORCID: 0000-0001-6279-4481
UK-QSAR & Cheminformatics Group @ukqsar.bsky.social We organise two one-day meetings per year in the UK, and always free to register.
The #UKQSAR & #Cheminformatics Group is for scientists interested in approaches to #CompChem #DrugDesign #MedChem #BigData #DataScience #RealTimeChem
https://ukqsar.org
Nathan Brown @nathanbroon.bsky.social Cheminformatics scientist living in #Aarhus #Denmark • Chair @UKQSAR • FRSA FRSB FRSC
https://scholar.google.com/citations?user=N0-4IgoAAAAJ
David Ryan Koes @dkoes.compstruct.org Removing barriers to computational drug discovery one bit at a time. Associate Professor in Computational and Systems Biology at the University of Pittsburgh.
https://bits.csb.pitt.edu/
Odysseas Vavourakis @odyv.bsky.social Generative Antibody Design at Oxford | ovavourakis.github.io | 🇬🇧🇩🇪🇬🇷(🇪🇸) he/him
Sam Money-Kyrle @smkyrle.bsky.social PhD student @ Oxford | Researching AI for drug discovery in the Oxford Protein Informatics Group
Protein Data Bank in Europe (PDBe) @pdbeurope.bsky.social Developing macromolecular structure resources and tools for life science.
- Founding partner of the wwPDB.
- Manage the community-led PDBe-KB resource and the AlphaFold Protein Structure Database, a collaboration with Google DeepMind.
- Part of EMBL-EBI
The ASAP Discovery Consortium @asapdiscovery.bsky.social ASAP uses artificial intelligence and computational chemistry to accelerate structure-based open science antiviral drug discovery and deliver oral antivirals for pandemics with the goal of global, equitable, and affordable access.
COVID Moonshot @covid-moonshot.bsky.social On the ambitious mission to develop a safe, globally accessible, and affordable antiviral pill for COVID-19.
postera.ai/moonshot/
MedChemica @medchemica.com We supply knowledge based design and analysis software to help our clients focus on making the best compounds quickly. Our consulting services in medicinal chemistry and cheminformatics help your projects large or small move faster.
Ed Griffen @griffen-ed.bsky.social husband, father, son, brother, computational medicinal chemist, anti-infective drug discovery, perpetually curious, apprentice akidoka, school governor @MedChemica, @covid_moonshot, @asap_discovery
RDKit: Open source cheminformatics @rdkit.bsky.social https://www.rdkit.org
https://github.com/rdkit/rdkit
Martin Buttenschoen @buttenschoen.uk Interested in small molecule drug design.
Lucy Vost @lucyvost.bsky.social PhD student @OPIGlets working on ML methods for small molecule drug design
Bluesky @bsky.app official Bluesky account (check username👆)
Bugs, feature requests, feedback: support@bsky.app