Assistant Professor (Tenure Track) Uni. Rome TOV. Previously researcher @sns.it, PostDoc NTNU, PhD @scuolanormale
@erc.europa.eu STG2025 #sommelier
Associate professor of theoretical chemistry at University of Modena and Reggio Emilia. Interested in molecular simulations, catalysis, reactivity.
Theoretical Chemistry Research Group @ RWTH Aachen University
https://ipc.rwth-aachen.de/Bannwarth
Theoretical chemist | Quantum dynamicist | Asst. Prof.
@CUBoulder | www.montoyacastillogroup.com
#MolecularSimulations | Associate Professor Tel Aviv University | PostDoc: Rothschild Fellow, Parrinello group, ETH Zurich | PhD: Adams Fellow, w/Benny Gerber, Hebrew University
Assistant Professor, IISc Bangalore and Head, Max-Planck Partner Group of MPI für Kohlenforschung. Understanding molecular basis of life using computers 💻 🧬
Web: https://sites.google.com/view/sirohiwal-lab/home
We perform research in theoretical chemistry, specifically classical and quantum statistical mechanics, mathematical approaches, and machine learning methods applied to condensed phases.
In Silico Photochemistry Group (Basile Curchod) at the University of Bristol. https://in-silico-photochem.com
physical and computational chemist with interest in photochemistry, radiation chemistry and X-ray technologies
CNRS senior research at the Laboratoire de Chimie et Physique Quantiques in Toulouse (France) interested in electronic structure theory & excited states
Theoretical and computational chemist, young researcher. Piano and photography enthusiast.
Dad to four humans and three shih tzus. Professor of Chemistry, mass spectrometrist, physical chemist, associate dean of science.
Theoretical chemist studying the quantum properties of molecules.
@royalsociety.org University Research Fellow at @uclchemistry.bsky.social.
Previously @downingcollege.bsky.social and @newcollegeoxf.bsky.social.
www.hughburton.com | x.com/HughGABurton
Professor at Stockholm University, Sweden. Weekend violinist. We study how enzymes work and how biological systems capture energy.
opinions my own | proud dad of four | quantum chem prof and VP & grad dean @ UC Merced | Michigan native
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
Senior Lecturer in Physics at Queensland University of Technology (QUT), Australia. Computational Physicist, Quantum Chemist, Data Scientist, ARC DECRA Fellow, she/her #compchem #ozchem
https://www.qut.edu.au/about/our-people/academic-profiles/xiuwen.zhou
Associate Professor at Hoffmann Institute of Advanced Materials in Shenzhen Polytechnic University. Machine learning computational chemist.
Studying Light-Matter Interactions at Texas A&M
Theoretical Chemistry, Light-Matter Interactions, Quantum Dynamics
https://mandalgrouptamu.com
#compchem #chemsky #theochem
Quantum Dynamics, Ultrafast Spectroscopy Simulations, Computational Chemistry, Theoretical Physics
computationalspectroscopy.eu
Theoretical Chemistry research group @lct-umr7616.bsky.social, Sorbonne Université & CNRS| Led by Prof. Piquemal (@jppiquem.bsky.social)|
#compchem #HPC #MachineLearning #quantumcomputing
Website: https://piquemalresearch.com
Theorist, usually chemistry.
Assoc. Prof @StJohnsU Chemistry.
Pronouns: he/him/él
Mexican American. 🇲🇽🇺🇸
Maths, molecules, finance, ML. An Australian in a Silicon Valley.
Senior scientist with @letigonzalez at University of Vienna, SHARC and iStOMPS enthusiast
PERSONAL ACCOUNT
他/he/him
Some call me NYC's AI Czar.
🐕🦺🇸🇬🇺🇸
Asst. Professor of Physics, Chemistry, Mathematics, Neural Science at NYU | Simons Foundation Faculty Fellow | Open Science http://colabfit.org
martinianilab.org
Assistant Professor of Digital Chemistry at @ethzurich.bsky.social. Making chemistry more sustainable within NCCR Catalysis. Views my own.
https://dcl.ethz.ch
https://www.valencekjell.com
Theoretical chemist. Research interests in optimisation (basis sets) and using AI/ML in sustainable chemistry
Teaching interests in digital chemistry and active learning
Computational Chemist. Associate Professor at the University of Oxford. Organic Chemistry Fellow at Hertford College. 🇨🇱
Assistant Professor of Computational/Theoretical Chemistry @Northeastern University (Boston) | https://sdonglab.org | Twitter: @sijia_dong
Professor at UC San Diego. Computational biophysics, biology, chemistry. Multiscale modeler. Viruses. Cancer. Co-Director of the Airborne Institute.
Research Scientist @MIT
Former ChemE Prof @UFRJ and Principal Scientist @RedesignScience. #CompChem #ML4Chem #ChemSky
We are a computational research group at Newcastle University led by #UKRIFLF Dr Danny Cole specialising in atomistic simulations in medicinal chemistry and biology https://blogs.ncl.ac.uk/danielcole/
RamO(N) Miranda Quintana
Theoretical and Computational chemistry
https://quintana.chem.ufl.edu/
#chemsky #compchemsky
Quantum chemist at Cardiff
Computational Chemist. Associate Professor at UCL. Associate Editor for the Journal of Materials Chemistry C and Materials Advances (RSC).
Tries to pass as a computational chemist. Bostero fanatic. He/Him. Comments are my own and do not reflect my institution.
Husband, Dad, PhD, pedant, former Chief Ed of @natchem.nature.com, now Editorial Director at @NaturePortfolio.nature.com. Wine, chemistry, publishing, words & snark. Views ranty, but all mine. #ContaminatedBlood victim (affected). He/Him
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
https://deprincelab.github.io/
Professor of theoretical & computational chemistry at University of Alberta. Department Chair. VP Canadian Society of Chemistry. Like hiking, biking, x-country skiing, & beer. Pronouns: he/him/his
Associate professor at NCU, Poland.
Developing advanced methods for atomistic simulations.
Passionate about comp chem and biophysics.
Researcher and undergraduate educator.
Fixed-Term Assistant Professor, CMSE, Michigan State University.
Director of the Duke University Center for Computational and Digital Health Innovation. Alfred Winborne Mordecai and Victoria Stover Mordecai Associate Professor of Biomedical Engineering. Research in HPC and digital twins for health.
Associate Research Professor Ghent University * @ERC.europa.eu StG Grantee - STRAINSWITCH * Engineering Physicist * Co-president @JongeAcademie.bsky.social
Training ground of molecular torturers. Always excited about Quantum Frontiers of Matter. Nonequilibrium matter rocks.
https://sas.rochester.edu/chm/groups/franco/
@timgould_scienc on twitter
I do Medicinal Chemistry for viral proteases. Ginger cat and golden retriever dad. Football and non-cycling cycling fan. Chronic pain and immune compromised scientist on the slippery slope to retirement.
📍Brisbane, Queensland, Australia
Content development editor @rsc.org focusing on North America. Theoretical chemist. LEGO fan. #DFT #compchem #chemistry #DogsofCompChem #Quantum
Proud member of #ChemSky
Personal+work account (all views my own)
📍Buffalo, NY
Doing quantum chemistry at @p_lodz_pl
Associate Professor of Computational Chemistry, University of Birmingham
https://www.grynova-ccc.org/
views my own
Associate Prof at Georgia Tech. Low-cost semiconductors #solar #optoelectronics. Previously: UConn -> EPFL -> MIT. Opinions my own. He/his
Professor at the University of Chicago. Previously at U Minnesota and U Geneva. From Italy. I value a culture of diversity and solidarity.
https://gagliardigroup.uchicago.edu/
Gompf Family Professor of Chemistry, @JHUChemistry, @JohnsHopkins. Views are my own.
Riniker research group, ETH Zurich
🇪🇸
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
CompChemist. Baseball fanatic. Casual cyclist. Dad. #CompChem -> https://joaquinbarroso.com
Computational chemistry and biophysics. Empirical force fields, CADD, RNA, carbohydrates, and methods developments including SILCS (site identification by ligand competitive saturation, See SilcsBio LLC) and enhanced-sampling GCMC. And I surf....
Expert in biomolecular simulation and biophysics.
http://membrane.urmc.rochester.edu/
http://grossfieldlab.github.io/loos/
https://orcid.org/0000-0002-5877-2789
Machine learning for different domains ranging from graphic design to chemistry.
Physics, Chemistry, Nanoscience
Ultrafast Computational Spectroscopy
http://computationalspectroscopy.eu
Groningen
Computational chemist, curious about the atomic-scale structure of materials & ML for chemistry. Professor of Materials Chemistry at the University of Oxford
▪️P @icreacommunity.bsky.social & UdG Prof TheoChem
▪️S @spinstatepapers.bsky.social
▪️F @rsc.org
▪️M @acad-euro.bsky.social
▪️E @ica-papers.bsky.social
▪️ORCID: https://orcid.org/0000-0002-8174-8488
▪️🇳🇱 Views my own
▪️Pronouns: he/him/his
▪️Web: @marcelswart.eu
Ab initio materials simulations at Duke University. Associate professor, Duke MEMS & Chemistry. https://aims.pratt.duke.edu/ . Opinions my own. Unlike the shirt on the right side of the profile image, which is not my own. The number on the shirt is 10.
Associate professor in the Department of Chemistry at Carleton University. www.rowleygroup.ca
New PI in theoretical chemical physics at Sandia Natl. Labs. Studying photodynamics in molecules & materials. All views mine.
Professor of Theoretical Chemistry @sorbonne-universite.fr & Director @lct-umr7616.bsky.social| Co-Founder & CSO @qubit-pharma.bsky.social | FRSC (My Views)
https://piquemalresearch.com | https://tinker-hp.org
Professor #compbiophys #compchem @UT_Dallas
QM/MM force fields DNA rep./modif., cancer biomarkers, ionic liquids, #SACNAS, views my own, he/él 🇲🇽🇺🇸
Computational Materials Chemist
Lehigh Chemistry
(she/her) Last name pronounced Fred+Dean said quickly ;)
Strictly personal opinions on high-performance computing, computational chemistry, Fortran, GPUs, MPI. Suomessa.
Professor of theoretical chemistry / molecular physics at Aix Marseille University. Member of Institut Universitaire de France. Newton-X designer.🧪
Thinks about chemical education, theoretical chemistry, open science, molecular dynamics, and ice. The first “Dr. Who” for the Jmol team, Bagpiper, Dad. Chemistry Professor & Department Chair @ University of Notre Dame. Posts are my own.
#CompChem #Radiochem at the University of Iowa. Loves cats and avoiding the news. UMN Alum. Former Air National Guard member.
Assistant Professor at Princeton. Quantum-chemical engineer and materials designer.
https://rosen.cbe.princeton.edu
Senior researcher @CNRS, computational chemist. Professor @ENS_ULM @PSL_Univ. First responder & instructor @CroixRouge. (Opinions are my own.)
Associate Professor of Biochemistry at Virginia Tech. Comp Chem, CADD, and Drude FF contributor. Opinions my own. Go Hokies!
Assistant professor of computational chemistry at Wayne State University (Detroit). Computational simulations of fluorescent biomolecules. PhD@Cisneros, PD@Martinez #bifurious
Rev John A. Zahm Professor of Science, Univ Notre Dame -interested in renewable energy, nanoscience, material science, photochemistry, electrochemistry and scientific publications.
Editor-in-Chief @ACS Energy Letters. Views are my own
(URL: Kamatlab.com )
Chemistry professor at CMU. Connecting chemical sciences with AI #MachineLearning and automated experimentation. #tarheels fan. Care: #design, #photography #Ukraine #cats🐈 Rants are mine
Theoretically, chemist. Asst. Prof. of Chemistry, Columbia University and Associate Research Scientist, Flatiron Institute. https://haitgroup.com/
Computational photochemist -Associate Professor of Chemistry at Northeastern University (he/his 🏳️🌈)
Physicist, professor @univie.ac.at, computational physics, statistical mechanics, machine learning, soft matter, biking, hiking, skiing, *320 ppm. 🇪🇺
Theoretical chemistry group UCB_Chemistry, working in the areas of quantum dynamics and nonequilibrium statistical mechanics http://www.cchem.berkeley.edu/dtlgrp/
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
Computational chemist at the University of Copenhagen #compchem
Computational Science and Modelling of materials and molecules at the atomic-scale, with machine learning.
Professor for Theoretical Chemistry at TU Braunschweig
http://www.christophjacob.eu
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.
Statistical mechanic working on generative models for biophysics and beyond. Assistant professor at Stanford. https://statmech.stanford.edu
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
official Bluesky account (check username👆)
Bugs, feature requests, feedback: support@bsky.app
