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Adeesh Kolluru — most-cited papers & profile · AI for Science
← authors
·
overview
Adeesh Kolluru
7
papers ·
191
citations ·
9
h-index
Google Scholar ↗
Semantic Scholar ↗
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Most-cited papers
Open Challenges in Developing Generalizable Large Scale Machine Learning Models for Catalyst Discovery
2022 · 64 citations
Rotation Invariant Graph Neural Networks using Spin Convolutions
2021 · 51 citations
Spherical Channels for Modeling Atomic Interactions
2022 · 36 citations
From Molecules to Materials: Pre-training Large Generalizable Models for Atomic Property Prediction
2023 · 22 citations
The Open Catalyst 2022 (OC22) Dataset and Challenges for Oxide Electrocatalysts
2022 · 14 citations
TorchSim: An efficient atomistic simulation engine in PyTorch
2025 · 4 citations
Beyond Force Metrics: Pre-Training MLFFs for Stable MD Simulations
2025
Top co-authors
C. Lawrence Zitnick
· 5
Abhishek Das
· 4
Muhammed Shuaibi
· 4
Anuroop Sriram
· 3
Zachary Ulissi
· 3
Brandon M. Wood
· 2
Brandon Wood
· 2
Janice Lan
· 2
Aditya Grover
· 1
Aini Palizhati
· 1
Amir Barati Farimani
· 1
Ammar Rizvi
· 1
Topics
Materials
Chemistry
Physics ML
Climate & Weather
Drug Discovery