Scarso bassista, mediocre fisico.
Made in Rome.
Mi occupo di Scientific Computing and Application Performance
(SCAP)
Ma guardate l'idrogeno tacere nel mare
Guardate l'ossigeno al suo fianco dormire
Chemistry: Covered. The latest news, research, features and opinion from across the chemical sciences. Published by the Royal Society of Chemistry.
https://www.chemistryworld.com/
A group of computational chemists at UCLA. We study catalysts, materials, and complex (bio)molecular systems (and make them better!).
Student-run account.
https://alexandrova.chem.ucla.edu/
In Silico Photochemistry Group (Basile Curchod) at the University of Bristol. https://in-silico-photochem.com
The Royal Society is a Fellowship of many of the world's most eminent scientists and is the oldest scientific academy in continuous existence.
https://royalsociety.org/
Promoting fundamental research on advanced computational methods
EPCC, part of the University of Edinburgh, is the UK's first National Supercomputing Centre, leading in High Performance Computing, AI and Data Science expertise.
Theoretical Chemist; Group leader at the Wrocław University of Science and Technology; interested in biomolecular (photo)chemistry, photoinduced electron transfer and prebiotic chemistry; avid runner;
https://iam.pwr.edu.pl/people/rafal-szabla
Urgent short communications of outstanding significance from across the chemical sciences. Email: chemcomm-rsc@rsc.org
Published by @rsc.org 🌐 Website: rsc.li/chemcomm-journal
An international journal co-owned by 19 physical chemistry and physics societies from around the world. This journal publishes original, cutting-edge research in physical chemistry, chemical physics and biophysical chemistry.
🌐 Website rsc.li/PCCP
Flagship journal for @rsc.org, open access with no publication fee, all topics in chemistry. chemicalscience-rsc@rsc.org 🌐 Website: rsc.li/chemscience
Scientific Editor of @chemicalscience.rsc.org, the flagship journal of the Royal Society of Chemistry. Diamond open access! | bioinorganic chemist | PhD Stanford University, post-doc University of York | wife, mum, gardener, Christian | she/her
Improving all lives through the transforming power of chemistry
A Program for Atomic and Molecular Direct Iterative Relativistic All-electron Calculations.
Your friendly companion for explorations across the bottom of the periodic table. For more information check out our website https://diracprogram.org/
The UK Catalysis Hub is a consortia of universities involved in catalysis research. It brings together forty-six universities, fifteen companies, the STFC Harwell science facilities and thirteen international partners.
https://www.ukcatalysishub.co.uk
Computational Chemist | Postdoctoral Researcher @PNNL | PhD @MPIKofo | Likes to study proteins in silico 🧬👩💻 🇮🇳🇺🇸
Inspiring the future
ucl.ac.uk/chemistry/
http://instagram.com/ucl.chemistry/
CNRS senior research at the Laboratoire de Chimie et Physique Quantiques in Toulouse (France) interested in electronic structure theory & excited states
physical and computational chemist with interest in photochemistry, radiation chemistry and X-ray technologies
**Quantum & Computational Chemistry
#compchem #theochem #DFT 💻🌍💭
**Scientist and Senior Lecturer at University of #Alicante, Spain. 🇪🇸☀️🥘🍤🍊⛵️⛱️
**Editor-in-Chief of Theor. Chem. Acc. (founded in 1962, the oldest journal in our field) Views are my own
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....
Computational Chemist. Associate Professor at UCL. Associate Editor for the Journal of Materials Chemistry C and Materials Advances (RSC).
Angewandte Chemie, a journal of the German Chemical Society (@gdch.de), is a leading journal in #chemistry published by Wiley-VCH (@wiley.com) in Weinheim, Germany
https://onlinelibrary.wiley.com/journal/15213773
Materials modeller and writer of spaghetti code.
Advanced molecule editor and visualizer
Currently working towards Avogadro2
https://two.avogadro.cc/
https://discuss.avogadro.cc/
Chemist, Scientist, Husband, Dad, Runner, Teacher. I develop Avogadro + OpenBabel to find new materials for energy applications @Pitt_Chemistry he/him
Scientist & Scuba Diver - I love theoretical physics, sharks, and pygmy seahorses - http://www.instagram.com/clementicecilia - http://www.physik.fu-berlin.de/en/einrichtungen/ag/ag-clementi
principal scientist at imec
first principles research on semiconductors
father, husband, bassoonist, aikidoka, equestrian
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
Research scholar, #ML #software #compchem @IITKGP @AnoopLAB
Senior scientist with @letigonzalez at University of Vienna, SHARC and iStOMPS enthusiast
AI/ML for Science & DeepTech | PI of the AI for Materials Lab | Prof. of Physics at UAM. https://bravoabad.substack.com/
We are the biomolecular and pharmaceutical modelling laboratory directed by Prof. Gervasio at Uni Geneva and UCL London. We develop enhanced sampling algorithms and perform simulations on systems bio-pharmaceutical interest (GPCRs, kinases, ...)
Associate Professor in Materials Physics at the University of Bristol. Editor-in-Chief of Materials Today Communications. Father of a toddler and a cat, husband. Science fiction author, miniature painter, climber, nerd. He/him
Assistant Professor UAS at HES-SO Valais-Wallis 🇨🇭 🤗 HF Fellow. Working on AI, Protein Design and Open Science. Creator of bioicons.com
Computational Chemist. Associate Professor at the University of Oxford. Organic Chemistry Fellow at Hertford College. 🇨🇱
Computational Chemist, drug developer, scientist, husband, dad of 3, Ex-Academic, Austrian, raised in Ger, lived in the UK, arrived in Sweden
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
Professor in Computational Materials Chemistry at Imperial College (she/her).
Development and application of efficient computational chemistry methods - based @unibonn.bsky.social.
This account is managed by group members of Prof. Stefan Grimme.
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
theoretical chemist turned research software engineer - CodeRefinery, open science, research, software, data, computing, teaching, oceanography, computational geometry, baking, occasional 8-bit stuff - he/him
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 🇳🇱🇪🇺🇬🇧
Professor, Head of Digital and Data-Driven Chemistry, School of Chemistry and Chemical Engineering at @unisouthampton.bsky.social
Associate Editor at Chemical Science (@roysocchem.bsky.social)
structure prediction, materials discovery
Virtual Chemist; Liúdramán; Personal Opinions
Professor of Chemistry, University of Bristol. Computational chemistry,enzyme catalysis, biomolecular simulation,HPC,antibiotic resistance.Views my own.
I design quantum computers @physicsstrath.bsky.social and @ccp-qc.bsky.social
https://kendon.info/viv
Collaborative Computational Project on Quantum Computing - UKRI/EPSRC funded network linking computational scientists and engineers with quantum computing experts https://ccp-qc.ac.uk
Posting about all things related to Data-driven research and the Physical Sciences Data Infrastructure programme funded by EPSRC.
www.psdi.ac.uk
Structural biologist and beamline scientist at Diamond light source, Hon Prof @ University of Essex. Interested in room temperature macromolecular crystallography, serial and time resolved work - and metalloproteins.
theoretical physical chemist, molecular modeller and chem- and bioinformatician - #AlphaFoldology enthusiast
Palacky University Olomouc, ORCID:0000-0001-9472-2589 #boardgamegeek (tweets my own) #ELIXIRCZ
Scientist, #MachineLearning and #AI for Moleculear Sciences. Scuba Diver. Loves @cecclementi.bsky.social
Computational Organic Chemist
@University of Manchester #CompChem 💻 ⚛️ #Catalysis
🇪🇸 → 🇬🇧 | Mum of 3 boys 🤩
Cyclist 🚴♀️ | Yogi 🧘♀️ | Amateur cook
Rock music fan 🎸
🔗 https://trujilloresearchgroup.com/
Computational chemistry and AI for drug design in biotech #compchem | CSIRO, Melbourne AU
Professor of Biophysics, Drug Discovery, Photographer, Traveller and a Cultural succupus.
Professor of Materials Modelling in School of Engineering at University of Warwick, Director of Warwick Centre for Predictive Modelling and EPSRC HetSys CDT. Develop multiscale materials modelling methods and software. warwick.ac.uk/jrkermode
Chair of Theoretical Chemistry and Head of the School of Chemistry at Trinity College Dublin
Professor @BristolChem, gardener, drinker of tea, Labrador executive assistant. Counts in German & swears in English. She/Her. All views my own.
ORCID: 0000-0003-0609-475X
Computational biochemist, interested in neuronal signalling at the atomic level and computer-aided drug design. All views my own.
bigginlab.web.ox.ac.uk
Research Scientist at ProImmune. Biochemistry to help make Ankyron® protein binders. Former crystallographer. I love #SciComm, #Sustainability, #Climbing and #EDM. Views are my own. He/Him.
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/
Professor of Physics, University of Warwick. Large-scale electronic structure (LS-DFT), 2D materials, theoretical spectroscopy, developer of ONETEP and ESTEEM.
▪️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
PhD Student at University of Notre Dame | Computational Chemistry | Heterogeneous Catalysis
Molecular modeling, simulations, metadynamics, machine learning
This is the BlueSky presence of the FHI-aims electronic structure code - https://fhi-aims.org/ . FHI-aims is a community-based electronic structure code for materials and molecules, efficient, all-electron, up to very large systems.
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.
Scientist, open sourcerer, love the beach. Work at NVIDIA. Opinions are my very own and not necessarily reflecting anyone else's! Be well
The UK’s largest public funder of research. Our mission is to advance knowledge, improve lives and drive growth.
#FundedByYou
Also autoposting to @news.ukri.org, @funding.ukri.org, @blogs.ukri.org and @events.ukri.org. Topic specific feeds coming soon!
With the future of the world in the balance, everyone has a role to play in making it better. How will you join in?
🌐 Website: www.rsc.org
Computational biochemist (he/him), PI of the http://vanderkampgroup.com. Likes #enzymes & #compchem, #diversity #inclusion
Computational chemist at the University of Copenhagen #compchem
Independent consultant. #Educator #Facilitator #Training #MaterialsModelling #BusinessBenefits #Ontologies #Dissemination
https://www.simperler-consulting.com/
Professor, Georgia Tech Chemistry and Biochemistry. Georgia Research Alliance Eminent Scholar. Senior Editor, Protein Science, Editor-in-Chief, Electronic Structure. Pianist, photographer, foodie, dreamer, mom. She/they. #FirstGen #MENA All views my own.
I'm a materials physicist pretending to be a chemist and an engineer. I don't think anyone is convinced. Opinions mine. Corcaigh abú. (He/him)
Prof of Computational Microbiology. Oxford Biochemistry & St Anne’s College. Bacterial Cell Envelopes. LFC fan 🌈
To physicists: a chemist. To chemists: a physicist. To mathematicians: an empty set.
RSURF & Lecturer, Imperial College London.
Computational chemist / physicist.
Photovoltaics, batteries, antibacterial peptides; lasers, cryostats, (ML)(Q)MC/MD/TB/DFT.
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
Computational chemistry professor at @unistuttgart.bsky.social simulating reaction mechanisms, atom tunneling, astrochemistry, MachineLearning.
https://www.uni-stuttgart.de/theochem/kaestner
Assistant Professor at Princeton. Quantum-chemical engineer and materials designer.
https://rosen.cbe.princeton.edu
official Bluesky account (check username👆)
Bugs, feature requests, feedback: support@bsky.app
