Blog Posts | Joshua Berkowitz

6 Articles

computational chemistry ×

Skala: The Deep Learning Breakthrough Accelerating Computational Chemistry

What if you could forecast chemical reactions and design new materials with laboratory-level precision, all without setting foot in a lab? Skala, a revolutionary deep-learning-based exchange-correlati...

AI for Science Azure AI computational chemistry deep learning density functional theory Microsoft Research molecular simulation

Oct 13, 2025

0 528

News

Hybrid Quantum-Classical Algorithms Set New Benchmarks in Quantum Chemistry

Quantum computing is rapidly transforming the way scientists approach complex problems. A breakthrough study has introduced a streamlined workflow that merges quantum and classical computing to model ...

computational chemistry error mitigation GPU acceleration hybrid algorithms quantum chemistry quantum computing quantum hardware

Aug 7, 2025

0 2266

News

Deep Learning is Revolutionizing Computational Chemistry at Microsoft

Thanks to recent breakthroughs at Microsoft Research , scientists may be able to forecast the properties of new molecules with laboratory-level accuracy, all from behind a computer screen. By marrying...

AI research computational chemistry deep learning density functional theory machine learning materials science molecular modeling

Jun 29, 2025

0 3509

News

How NVIDIA, AWS, IonQ and AstraZeneca Are Using Quantum Computing to Revolutionize Drug Discovery

Drug discovery has long been defined by painstaking research and drawn-out timelines. Now, a partnership between IonQ , AstraZeneca , AWS , and NVIDIA is reimagining what’s possible in pharmaceutical ...

AWS computational chemistry drug development hybrid workflows IonQ NVIDIA pharmaceuticals quantum computing

Jun 9, 2025

0 4235

News

Scalable Chemistry Simulations: Quantum Supercomputing’s Breakthrough Moment

Simulating intricate chemical reactions may not be limited by computational power any longer thanks to Quantinuum’s revolutionary, error-corrected, end-to-end computational chemistry workflow. This le...

AI integration computational chemistry error correction innovation materials science quantum computing scientific research supercomputing

May 22, 2025

0 1738

News

Open Molecules 2025: Transforming Chemistry with AI-Ready Data

The scientific world is abuzz with the debut of Open Molecules 2025 (OMol25), a dataset poised to redefine what's possible in computational chemistry and artificial intelligence. Developed through a c...

AI models computational chemistry datasets DFT drug discovery machine learning materials science molecular simulation

May 17, 2025

0 5533

News

Get All The Latest Research & News!

Subscribe

Our latest content

Check out what's new !

See all

Ads

Prompt Maker Image Generator

Struggling with the perfect AI image prompt? My free app helps you generate brilliant ideas and instantly creates an image to match. Go from concept to creation in two clicks!

Most Popular Articles

Check out what the hot topics are!

See all

Every shirt tells a story—and every story

#ClothingForACause