CompChemSky
Computational Chemists, Computational Molecular Biologists, Biophysics, AI&Chem, Chemoinformatics, Theoretical Chemists, Comp. Mat. Sci. + adjacent at BlueSky. Please let me know who I missed
Created by
@marwinsegler.bsky.social
@garantes.bsky.social
Professor & Scientist @uspoficial.bsky.social 🇧🇷. Computational (bio)chemistry and biophysics. 👨👩👧👦 Father of 2. ⚽ Corinthians Web: http://gaznevada.iq.usp.br SciComm: https://eq5e.short.gy/mkwHIV 🐦 : x.com/ArantesLab 🎵 : www.dinamicas.art.br
@sykhalid.bsky.social
Prof of Computational Microbiology. Oxford Biochemistry & St Anne’s College. Bacterial Cell Envelopes. LFC fan 🌈
@lynnkamerlin.bsky.social
Professor, Georgia Tech Chemistry and Biochemistry. Georgia Research Alliance Eminent Scholar. Senior Editor, Protein Science. American, British, Swedish, Kurdish. Pianist, photographer, foodie, dreamer, mom. She/they. #FirstGen #MENA All views my own
@marcvanderkamp.bsky.social
Computational biochemist (he/him), PI of the http://vanderkampgroup.com. Likes #enzymes & #compchem, #diversity #inclusion
@letigonzalez.bsky.social
🇪🇸 Chemist • Professor at University of Vienna • Theoretical chemistry, quantum chemistry, excited-state dynamics • Home of SHARC 🦈 Senior Editor of ACS Central Science • Board of Directors, Cluster of Excellence MECS ☀️ She/her/wife/Mom of 2
@sacquin-mo.bsky.social
CNRS research director modelling #Proteins. Lab. Biochimie Théorique UPR9080, IBPC #WomanInSTEM Website: http://www-lbt.ibpc.fr/people/sacquin Popularization blog (in french): https://topoftheprots.com/
@miarosenfeld.bsky.social
machine learning drug discovery scientist @ iambic tx | neuralplexer developer computational biophysicist, glycoscientist, feminist, jewish, lover of sufjan stevens. she/they 🏳️🌈 ✡︎ 📍 san diego/nyc
@arwalker.bsky.social
Assistant professor of computational chemistry at Wayne State University (Detroit). Computational simulations of fluorescent biomolecules. PhD@Cisneros, PD@Martinez #bifurious
@greglandrum.bsky.social
Cheminformatician, developer, climber, runner, hiker, cook ORCID: 0000-0001-6279-4481
@sukritsingh92.bsky.social
Biophysicist｜Damon Runyon QB & NCI Early Stage K99/R00 Fellow at MSKCC w/ @jchodera.bsky.social | Team @foldingathome.org | PhD with @drgregbowman.bsky.social | Drug resistance, Protein dynamics, Dogs, Games My website: https://sukritsingh.github.io
@johnparkhill.bsky.social
Senior director of machine learning @ Terray Therapeutics (https://www.terraytx.com/). Father. NSF CAREER award giver-upper. Gibe and gambol enjoyer. Refugee from https://x.com/j0hnparkhill. http://bbgky.net
@micaelamatta.bsky.social
#compchem | organic semiconductors | functional biomaterials | polymers | @mdanalysis core dev | made in Sardinia 🏳️🌈 she/her
@elisedd.bsky.social
CNRS researcher working at the Laboratoire de Biochimie Théorique (LBT), in the Institut de biologie physico chimique (IBPC) in Paris. #RNA #Enzymes #compchem #molecularSimulations
@ewcspottesmith.bsky.social
Incoming Asst. Prof., ChemE, Carnegie Mellon University | Editor, @joss-openjournals.bsky.social | Personal: espottesmith.github.io | Research group (@coreacter.org): coreacter.org | orcid.org/0000-0003-1554-197X | All opinions mine
@jnknssj.bsky.social
Professor at Cambridge University, Fellow of St Edmund's College, Student of Everything Else. Posting in a personal capacity. www.ch.cam.ac.uk/person/sjj24 orcid.org/0000-0001-9362-9665
@allaboutchemist.bsky.social
Quantum mechanic & machine learner. Senior principal scientist at Schrödinger, Inc. Sometimes a professor at The Cooper Union. https://orcid.org/0000-0003-0950-7775
@tallakahath.bsky.social
Computational chemist with a focus on QM, Force Fields, and how ML can aid in both. Also: Cosplayer, LARP writer, birder, occasional science communicator, and several other things. She/they.
@janhjensen.bsky.social
Computational chemist at the University of Copenhagen. Editor-in-Chief PeerJ Physical Chemistry. #compchem
@molecularxtal.bsky.social
Computational Chemist. 🦀🐍 Scientist at BAM + Professor FSU Jena. Only private opinions here. Last name: German pronunciation. 🏳️🌈 she/they (sie). @JaGeo on github
@labcosmo.bsky.social
Computational Science and Modelling of materials and molecules at the atomic-scale, with machine learning.
@handle.invalid
Trying to teach computers how to design materials. Leading a research group at FSU Jena/HIPOLE Jena. Increasing entropy since 1996.
@dermewes.bsky.social
Scientist, chemist, brewer, and dad working on the holy deep-blue grail of #OLED because: "Computers don't invent molecules, humans do!"
@thiagoreschutz.bsky.social
A chemical engineer that likes inverse design/modeling, dynamical systems, neural networks, thermodynamics, statistics etc. (whatever etc. means) 🇧🇷🇺🇾
@mcs07.bsky.social
Software and cheminformatics for drug discovery. Working at D. E. Shaw Research.
@bernadsz.bsky.social
Nature lover. Curious turned scientist. Part of the ORCA development team. Now bringing Quantum Theory and Molecular Physics to the real world at @faccts-orca.bsky.social https://scholar.google.com.br/citations?user=U6szjgMAAAAJ&hl=pt-BR
@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.
@christophjacob.eu
Professor for Theoretical Chemistry at TU Braunschweig http://www.christophjacob.eu
@guillemsimeon.bsky.social
(He/him) Physicist. Machine learning and atoms @ Microsoft Quantum. 🏳️🌈
@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.
@vlderinger.bsky.social
Computational chemist, curious about the atomic-scale structure of materials & ML for chemistry. Associate Professor at the University of Oxford
@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
@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
@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 🇳🇱🇪🇺🇬🇧
@geoffhutchison.net
Chemist, Scientist, Husband, Dad, Runner, Teacher. I develop Avogadro + OpenBabel to find new materials for energy applications @Pitt_Chemistry he/him
@pwk2024.bsky.social
Slayer of soucouyants but terrified of douens, centipedes and ceiling fans Blog (Molecular Design): https://fbdd-lit.blogspot.com/
@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
@jelfschem.bsky.social
Professor in Computational Materials Chemistry at Imperial College (she/her).
@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. 🇪🇺
@andrewrosen.bsky.social
Assistant Professor at Princeton. Quantum-chemical engineer and materials designer. https://rosen.cbe.princeton.edu
@martinvoegele.bsky.social
Computational Biophysicist, Amateur Photographer, History+Language Nerd. All views my own. Website: https://martinvoegele.github.io/
@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
@peonor.bsky.social
Chemist, husband, father, singer. Sustainability, catalysis, stereochemistry, predictive modeling. Senior Principal Scientist @astrazeneca.bsky.social Gothenburg. he/him
@aspuru.bsky.social
Professor of Chemistry and Computer Science University of Toronto Faculty member, Vector Institute Director, Acceleration Consortium My views expressed here are personal and are not those of my employers.
@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
@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.
@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