JCIM & JCTC Journals
@jcim_jctc
Tweets from Journal of Chemical Information and Modeling (JCIM) and Journal of Chemical Theory and Computation (JCTC) from @ACSPublications
ID: 3035084213
https://pubs.acs.org/ 13-02-2015 17:43:41
10,10K Tweet
9,9K Followers
966 Following
Olexandr Isayev 🇺🇦🇺🇸
@olexandr
#CompChem Prof @CMU_Chem. Connecting chemical sciences with AI & #MachineLearning. #tarheels fan. Care:#design, #photography #Ukraine #cats🐈 Rants are mine
Andrew White 🐦⬛
@andrewwhite01
Head of Sci/cofounder @FutureHouseSF. Prof of chem eng @UofR (on sabbatical). Automating science with AI and robots in biology. Corvid enthusiast
Adrian Roitberg 🏳️⚧️
@adrian_roitberg
Tries to pass as a computational chemist. Bostero fanatic. He/Him. Comments are my own and do not reflect my institution.
Abdurrahman Olğaç
@aolgac_evias
Patrick Walters
@wpwalters
cheminformatics, machine learning, drug discovery, opinions
Riccardo
@riccardosp
CNRS research director in Theoretical Physical Chemistry at Sorbonne Université. Lives in Paris. My tweets are personal, do not engage CNRS or SU.
Ariane Nunes Alves
@anunesalves
Computational Biochemist | Junior Group Leader @UniSysCat @TUBerlin | Associate Editor @jcim_jctc | 🇧🇷 #CompChem (ligand binding kinetics, crowding)
Horacio V. Guzman
@whoratz
Physicist and engineer, into multiple scale models of proteins/RNA/membranes, polymers, scientific computing, bicycles | Dad V tinyurl.com/goCompModeling
Rikhia Ghosh
@rikhiag
Computational biophysicist | Predictive Modeling and Simulation of Biomolecules | New Therapeutic Modalities| Drug Development & Design #CompChem #WomenInStem
pen(Taka)
@iwatobipen
Medicinal Chemist? Interested in Chemoinformatics, Running. Opinions and tweets are my own. @iwatobipen.bsky.soscial
Jorge Soto Delgado
@jor_soto
Dr. en Química - Diseño de Fármacos asistido por Computador
Andrea Brancale
@pallafatu
Chair of Medicinal Chemistry at the University of Chemistry and Technology, Prague
Jan Jensen (janhjensen.bsky.social)
@janhjensen
Computational chemist at the University of Copenhagen. PChem Editor-in-Chief @PeerJChemistry. #compchem
Pablo Arantes - @pabloarantes.bsky.social
@pablitoarantes
Research Scientist - Work interests mostly related to the simulation of biomolecular systems - Graças a Deus nasci na América Latina 🇧🇷
Ricardo Grau-Crespo
@rgraucrespo
Assoc. Prof. of Materials Theory @UniRdg_Chem, UK. Energy Materials, Disorder in Solids, Machine Learning. Assoc. Editor @JMaterChem A.
Syma Khalid
@profsyk
Prof of Computational Microbiology. Oxford Biochemistry & St Anne’s College. Bacterial Cell Envelopes. Chair of @hecbiosim. #computationalmicrobiology #LFC 🌈
Guido Tiana
@guidotiana
Francisco J. Enguita
@fenguita
Associate Professor and Senior Researcher, Lisbon Medical School, University of Lisbon, Portugal Molecular artist Instagram: paco.enguita
Jean-Philip Piquemal
@jppiquem
Professor of Theoretical Chemistry @ Sorbonne Université & Director @ LCT (UMR 7616 CNRS)| CSO & co-founder @qubit_pharma| FRSC (Views are mine) #compchem
Mehdi Beniddir
@beniddirm
Professor of natural products chemistry @UnivParisSaclay @BioCIS. Discovery of unprecedented natural products. Exobiology lover @mehdibeni.bsky.social
Piotr Piecuch
@piecuchpiotr
Univ. Dist. Prof. & MSU Foundation Prof. at Michigan State University, quantum chemistry and physics, proud husband and dad (started tweeting in late Dec. 2019)
Melchor
@melsanm
Scientist. CompChem & Cheminformatics. Life sciences, Pharma & Biotech. Drug Discovery. Precision medicine. Data science. Computation.
Ragothaman Yennamalli
@structbioinfo
Sr. Asst Prof @SastraUniv | Bioinformatician, He/Him. co-organizer #YIM2024, Asso.Ed @csb_journal, Spl Issue Ed @BiophysJ Ed BMC Bioinformatics, Protein Science
Daniel Devore, Ph.D.
@daniel_devore97
Computational Chemist, Postdoctoral researcher in Matthews Group at Southern Methodist University.
Mario Barbatti
@mariobarbatti
Theoretical chemist and physicist Professor Aix Marseille Univ Senior member @InstUnivFr Head of the ICR #TheoChem group orcid.org/0000-0001-9336…
The Journal of Physical Chemistry
@jphyschem
Editors of JPC L, JPC A, JPC B, & JPC C sharing physical chemistry research articles, analysis, news, & more—Part of the @ACSPublications portfolio of journals
Jorge Bravo
@bravo_abad
Prof. of Physics @UAM_Madrid | Profesor Titular. PI of the AI for Materials Lab | Director del Laboratorio de IA para Materiales.
Mohamad Moosavi
@moosavismohamad
Asst. Prof. of Chemical Engineering at the University of Toronto @ChemEng_UofT | #MachineLearning and #AI for the Chemical Sciences (he/him)
JCTC Papers
@jctc_papers
New papers in J. Chem. Theory Comput. (not affiliated with ACS)
Madhurima Jana
@madhurima217
Professor, NIT ROURKELA
Martin Elstner
@elstnermartin
Building @ElstnerAnalytic | Product-focused | Passionate about LLMs, search & data science | 🧠 Knowledge for LLMs & raising humans (dad x4)
Sergey Ovchinnikov
@sokrypton
Scientist, Assistant Professor @MITBiology, #FirstGen, ProteinBERTologist, 🇺🇦 Moving to: bsky.app/profile/sokryp…
Scott Reed
@readscottreed
Prof. of Chemistry
Vlad Cojocaru
@cojocarulab
Research Group Leader @ STAR-UBB Instiute @ Babes Bolyai University, Cluj-Napoca, Romania
Jordi Faraudo Gener @jfaraudo.bsky.social
@jordi_faraudo
SoftMatter Theory @icmabCSIC. Using physics and computers to understand soft matter, where phys-chem-bio-materials meet. PERSONAL profile. Opinions are mine.
GiovanniMaria Piccini
@giemmepi1
Associate professor of theoretical chemistry at @UNIMORE_univ. Interested in molecular simulations, catalysis, reactivity.
Kresten Lindorff-Larsen
@lindorfflarsen
Protein and coffee lover, father of two, professor of biophysics and sudo scientist at the #LinderstrømLang Centre for Protein Science 🇩🇰
Wojciech (Wojtek) Kopec
@wojciechkopec3
Lecturer @chemistry_qmul | Guest Scientist @compbiophys | Computational Electrophysiology simulations | Living with insomnia | 🇵🇱🇩🇰🇺🇸🇩🇪🇬🇧
Gerit Brandenburg
@jgbrandenburg
🎬 Director for #Digital #Chemistry @merckgroup 🚀 Founder and CEO @quastify 🏐 Volleyball coach 🏳️🌈 he/him 🇪🇺
Jerelle A Joseph
@jerelleaj
Assistant Professor @EPrinceton | Prev: @Kings_College @Gates_Cambridge | biomolecular condensates + computer simulations | (she/her)
midstlab
@midstlab
Multiscale Interactions and Dynamical Systems Theme Lab @sabanciu @alirana_atilgan @cananatlgn
Julia Westermayr
@jwestermayr
Assistant Prof. @UniLeipzig & passionate runner | #LINO22 | PostDoc @compsurfchem @warwickuni | PhD @theo_chem @univienna | ML/DL, photochemistry | she/her
Arthur Zalevsky
@arthurzalevsky
Bioinformatician@UCSF, Free Software enthusiast
Rocio Semino
@rs_chemist
Theoretical chemist, associate professor @Sorbonne_Univ_ @LabPHENIX #ERCStG
Igor Roncevic
@igor_roncevic
Lecturer in #compchem and #theochem at @OfficialUoM, previously MSCA fellow in @HLAGroupOx at @UniofOxford
Dirk Tomandl
@dirktomandl
Principal Data Scientist and Group Leader Cheminformatics in Drug Discovery. Classical Music Composer, sometimes using AI for inspiration.
Sargol Mazraedoost
@sargol_md
Ph.D. in Cheminformatics and Drug Discovery (PKNU) [email protected]
Ben Blaiszik
@benblaiszik
Group Leader - AI and data infrastructure for science at @uchicago/@argonne/@globus - @UofIllinois alum. materials, chemistry, physics. Opinions are my own.🤖🔬
Lab. of Chemistry of Informational Macromolecules
@labolutz
Group of Dr. Jean-François Lutz at I.S.I.S. @unistra @CNRSChimie @CNRS Working on information-containing macromolecules and digital polymers
Péter Nagy
@nagyrpeter
Quantum Chemist, research associate professor, head of Molecular Quantum Simulation group @BME_en, developer of mrcc.hu program package
RCNS MedChem Research Group
@keserulab
Medicinal Chemistry Research Group at the Research Centre for Natural Sciences, headed by György M. Keserű. Now also on Mastodon: @[email protected]
Theoretical Chemistry at TU Dresden
@theochem_tud
Chair of Theoretical Chemistry @tudresden_de of prof. @ThomasHeine14 with @DorotheaGolze Emmy-Noether and Rico Friedrich @DRESDEN_concept junior groups
Denys Biriukov
@denysbiriukov
🇺🇦 Computational biophysicist, multitasker, and beer lover. PI at @MasarykUni | Postdoc at @LabVacha @CEITEC_Brno | Researcher at @IOCBPrague | PhD at @PrfJU
Miguel Angel Chavez Fumagalli, PhD
@mchavezf_1
Researcher ∣ NTDs ∣ Bioinformatics
Itamar Borges Jr
@itamarborgesjr
Theoretical and Quantum Chemist. Research in quantum chemistry of functional materials, photochemistry, molecular dynamics and Machine Learning (ML).
Jesse Weller
@jssweller
PhD candidate, @USC_Physics and @qcb_usc, University of Southern California | ML in chemistry and biology | AI for drug discovery
Carla Molteni
@carlamolten
Professor of Physics at King's College London @KCL_Physics, co-Director Thomas Young Centre @tyc_london, President AISUK @aisuk_info
Computational BiopHysics Lab
@machuqueirolab
Researching pH effects, CpHMD Simulations, Membrane Permeabilities & Cancer Therapies @ BioISI | Lab's Head @MiguelMachuque1
Vibhu Jha
@vibhujha16
Asst Prof (Comp Drug Design) @ICT_Bradford @UniofBradford, Football and Cricket Lover
Marco De Vivo
@devivo_marco
Lab Head & Associate Director at @IITalk. Exec Editor of JCTC (@ACSPublications). Director cecamsimul.eu. Co-Founder @IAMABiotech. Passionate about science!
Kevin K. Yang 楊凱筌
@kevinkaichuang
Principal Researcher in BioML @MSFTResearch (@MSRNE). He/him/他. 🇹🇼
Andreas Schneemann
@schneesci
Liebig Fellow at TU Dresden, Germany. Interested in Metal Hydrides and Porous Materials #Chemistry
Kjell Jorner
@kjelljorner
Assistant Professor of Digital Chemistry at @ETH_DCHAB. Leader of the @DCL_ETHZ. Making chemistry more sustainable within @NCCR_Catalysis. Views my own.
Ingo Hartung
@hartungingo
discovery chemistry nerd @Merckgroup; oncology, immunology, targeted protein degradation, ADCs; soccer, politics, tapas can slip into the feed; my own views
Frank Noe
@franknoeberlin
Scientist, #MachineLearning and #AI for the Sciences (esp. Physics/Chemistry). Scuba Diver and Traveler.
Gili Bisker
@gilibisker
Associate Professor @TelAvivUni
Andrew S. Rosen
@andrew_s_rosen
Assistant Professor at @Princeton. Quantum-chemical engineer.
EPFL Chemistry
@epfl_chem_tweet
Institute of chemical sciences and engineering (ISIC) @ Ecole Polytechnique Fédérale de Lausanne (EPFL) - Switzerland
Francesca Grisoni
@fra_grisoni
Associate Prof. #AI for drug discovery | Leading @molecularML at @TUeindhoven & @ICMStue | @ELLISforEurope Scholar | Previously @ETH & @unimib | she/her 🏳️🌈
Alexey Orlov
@alexeyaorlov
Wandering in chemical, genomic, and (occasionally) compositional spaces. PhD in #medchem. PostDoc in #chemoinformatics. Opinions are my own