Gangan, Abhijeet S.

1. 34 Examples of LLM Applications in Materials Science and Chemistry: Towards Automation, Assistants, Agents, and Accelerated Scientific Discovery
   2025/05/05 by Yoel Zimmermann, Zimmermann, Yoel, Adib Bazgir +74 · 2 voices · 2 citations
   Materials Science · Medicine · Engineering · #Machine Learning in Materials Science #Artificial Intelligence in Healthcare and Education #Biomedical and Engineering Education
2. Force field optimization by end-to-end differentiable atomistic simulation
   2024/09/20 by Abhijeet Gangan, Samuel S. Schoenholz, Gangan, Abhijeet S. +7 · 1 citation
   Engineering · Materials Science · #Advanced Materials Characterization Techniques #Disordered Systems and Neural Networks (cond-mat.dis-nn) #Electron and X-Ray Spectroscopy Techniques #FOS: Physical sciences #Ion-surface interactions and analysis #Materials Science (cond-mat.mtrl-sci)
3. TorchSim: An efficient atomistic simulation engine in PyTorch
   2025/08/08 by Orion Cohen, Cohen, Orion, Janosh Riebesell +14 · 3 citations
   Biochemistry, Genetics and Molecular Biology · Materials Science · #Block Copolymer Self-Assembly #Computational Physics (physics.comp-ph) #FOS: Physical sciences #Machine Learning in Materials Science #Materials Science (cond-mat.mtrl-sci) #Protein Structure and Dynamics