Arif Ullah @ullaharif - Bluesky Profile

Latest posts by ullaharif.bsky.social on Bluesky

Machine learning meets su(n) Lie algebra: Enhancing quantum dynamics learning with exact trace conservation Machine learning has emerged as a promising tool for simulating quantum dissipative dynamics. However, existing methods often struggle to enforce key physical c

"Machine learning meets su(n) Lie algebra: Enhancing quantum dynamics learning with exact trace conservation" a collaboration with Jeremy O. Richardson (ETH Zurich) is now online in The Journal of Chemical Physics doi.org/10.1063/5.02...

25.06.2025 03:00 — 👍 0 🔁 0 💬 0 📌 0

YouTube video by Prof. Pavlo O. Dral Meet OMNI-P2x — the First Universal NN Potential for Excited States! #AI #chemistry #neuralnetworks

Meet OMNI-P2x — the First Universal #ML Potential for Excited States! #compchem #aichem #mlchem #neuralnetwork

youtube.com/shorts/sMr7Z...

- Preprint: doi.org/10.26434/che...
- Tutorial: github.com/dralgroup/om...
- Aitomistic Hub: www.aitomistic.xyz

13.05.2025 15:47 — 👍 3 🔁 2 💬 0 📌 0

YouTube video by Prof. Pavlo O. Dral Aitomia: Your Intelligent Assistant for AI-Driven Atomistic and Quantum Chemical Simulations

#aichem #compchem intelligent assistant Aitomia for #Aitomistic (AI+aitomistic) & quantum chemical simulations
More info at: mlatom.com/aitomia

16.05.2025 12:30 — 👍 5 🔁 2 💬 0 📌 0

@ullaharif is following 15 prominent accounts

Jean-Philip Piquemal
@jppiquem

Professor of Theoretical Chemistry @sorbonne-universite.fr & Head @lct-umr7616.bsky.social| Co-Founder & CSO @qubit-pharma.bsky.social (My Views) | https://piquemalresearch.com | https://tinker-hp.org

Jan H. Jensen
@janhjensen

Computational chemist at the University of Copenhagen. Editor-in-Chief PeerJ Physical Chemistry. #compchem

Pierpaolo Morgante (He/His)
@piermorgante

#MachineLearning editor at @iopp-mlresearch.bsky.social (@ioppublishing.bsky.social). Theoretical chemist. LEGO fan. #DFT #compchem #chemistry #DogsofCompChem #Quantum Proud member of #ChemSky Personal+work account (all views my own) 📍Buffalo, NY

<Matteo | Cavalleri> <He | Him | Dr>
@physicsteo

The twitter-er formerly known as @physicsteo. Recovered #CompChem-ist. Doing publishing stuffs @ AIPP. Brooklynite from 🇮🇹 via 🇪🇸, 🇸🇪 & 🇩🇪. http://matteo.cavalleri.eu

Marc van der Kamp
@marcvanderkamp

Computational biochemist (he/him), PI of the http://vanderkampgroup.com. Likes #enzymes & #compchem, #diversity #inclusion

<Joaquin | Barroso>
@joaquinbarroso

CompChemist. Baseball fanatic. Casual cyclist. Dad. #CompChem -> https://joaquinbarroso.com

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

the Piquemal Group
@piquemalgroup

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

Olexandr Isayev 🇺🇦 🇺🇸
@olexandr

Chemistry professor at CMU. Connecting chemical sciences with AI #MachineLearning and automated experimentation. #tarheels fan. Care: #design, #photography #Ukraine #cats🐈 Rants are mine

Robert Paton
@bobbypaton

Robert Paton | Fixman-Ladanyi Professor of Chemistry at Colorado State University | #compchem | http://linktr.ee/patonlab | 🇬🇧🇺🇸

Kyle Cranmer
@kylecranmer

Director Data Science Institute @UWMadison, Professor of Physics, EiC @MLSTjournal. Physics, stats/ML/AI, open science.

Jingbai Li
@jingbai-li

Associate Professor at Hoffmann Institute of Advanced Materials in Shenzhen Polytechnic University. Machine learning computational chemist.

Mario Barbatti
@mbarbatti

Professor of theoretical chemistry / molecular physics at Aix Marseille University. Member of Institut Universitaire de France. Newton-X designer.🧪

Pavlo O. Dral
@pavlodral

Prof. at Xiamen University and NCU in Torun, co-founder of Aitomistic. Researcher and educator in AI-enhanced computational chemistry. All opinions expressed are mine and do not necessarily reflect those of my employers.

Bluesky
@bsky.app

official Bluesky account (check username👆) Bugs, feature requests, feedback: support@bsky.app