Sayan Ranu
- GREED: A Neural Framework for Learning Graph Distance Functions
2021/12/24 by Rishabh Ranjan, Ranjan, Rishabh, Siddharth Grover +9 · 8 citations
Computer Science · #Advanced Graph Neural Networks #Bayesian Modeling and Causal Inference #FOS: Computer and information sciences #Graph Theory and Algorithms #Machine Learning (cs.LG)
- Unravelling the Performance of Physics-informed Graph Neural Networks for Dynamical Systems
2022/11/10 by Abishek Thangamuthu, Thangamuthu, Abishek, Suresh Bishnoi +8 · 5 citations
Physics and Astronomy · Materials Science · Engineering · #Model Reduction and Neural Networks #Machine Learning in Materials Science #Fuel Cells and Related Materials
- Global Counterfactual Explainer for Graph Neural Networks
2022/10/21 by Mert Kosan, Zexi Huang, Kosan, Mert +7 · 5 citations
Computer Science · #Explainable Artificial Intelligence (XAI) #Advanced Graph Neural Networks #Topic Modeling
- EGraFFBench: Evaluation of Equivariant Graph Neural Network Force Fields for Atomistic Simulations
2023/10/03 by Vaibhav Bihani, Utkarsh Pratiush, Bihani, Vaibhav +17 · 4 citations
Materials Science · Biochemistry, Genetics and Molecular Biology · Computer Science · #Machine Learning in Materials Science #Protein Structure and Dynamics #Topic Modeling
- Learning Articulated Rigid Body Dynamics with Lagrangian Graph Neural Network
2022/09/23 by Ravinder Bhattoo, Bhattoo, Ravinder, Sayan Ranu +3 · 3 citations
Computer Science · Physics and Astronomy · #Computational Physics and Python Applications #FOS: Computer and information sciences #Machine Learning (cs.LG) #Model Reduction and Neural Networks #Neural Networks and Applications
- StriderNET: A Graph Reinforcement Learning Approach to Optimize Atomic Structures on Rough Energy Landscapes
2023/01/29 by Vaibhav Bihani, Sahil Manchanda, Bihani, Vaibhav +7 · 2 citations
Materials Science · #Machine Learning in Materials Science
- Learning Heuristics over Large Graphs via Deep Reinforcement Learning
2019/03/08 by Sahil Manchanda, Manchanda, Sahil, Akash Mittal +9 · 3 citations
Computer Science · Physics and Astronomy · #Advanced Graph Neural Networks #Artificial Intelligence (cs.AI) #Complex Network Analysis Techniques #FOS: Computer and information sciences #Machine Learning (cs.LG) #Machine Learning (stat.ML) #Reinforcement Learning in Robotics
- TAGMol: Target-Aware Gradient-guided Molecule Generation
2024/06/03 by Vineeth Dorna, D. Subhalingam, Dorna, Vineeth +13 · 2 citations
Biochemistry, Genetics and Molecular Biology · #Advanced biosensing and bioanalysis techniques #Glycosylation and Glycoproteins Research #Advanced Biosensing Techniques and Applications
- Task and Model Agnostic Adversarial Attack on Graph Neural Networks
2021/12/25 by Kartik Sharma, Samidha Verma, Sharma, Kartik +7 · 1 citation
Computer Science · Materials Science · #Advanced Graph Neural Networks #Adversarial Robustness in Machine Learning #Cryptography and Security (cs.CR) #FOS: Computer and information sciences #Machine Learning (cs.LG) #Machine Learning in Materials Science
- Evaluating Universal Machine Learning Force Fields Against Experimental Measurements
2025/08/07 by Sajid Mannan, Vaibhav Bihani, Mannan, Sajid +13 · 1 voice · 4 citations
Computer Science · #FOS: Computer and information sciences #FOS: Physical sciences #Machine Learning (cs.LG) #Materials Science (cond-mat.mtrl-sci)
- Discovering Symbolic Laws Directly from Trajectories with Hamiltonian Graph Neural Networks
2023/07/11 by Suresh Bishnoi, Bishnoi, Suresh, Ravinder Bhattoo +6 · 1 citation
Computer Science · #Computational Physics (physics.comp-ph) #Computational Physics and Python Applications #Disordered Systems and Neural Networks (cond-mat.dis-nn) #FOS: Computer and information sciences #FOS: Physical sciences #Machine Learning (cs.LG) #Materials Science (cond-mat.mtrl-sci) #Time Series Analysis and Forecasting
- GRAIL: Graph Edit Distance and Node Alignment Using LLM-Generated Code
2025/05/04 by Samidha Verma, Verma, Samidha, Goyal, Arushi +5 · 3 citations
Biochemistry, Genetics and Molecular Biology · Computer Science · #DNA and Biological Computing #FOS: Computer and information sciences #Machine Learning (cs.LG) #Semantic Web and Ontologies #Service-Oriented Architecture and Web Services
- Bonsai: Gradient-free Graph Condensation for Node Classification
2024/10/23 by Mridul Gupta, Gupta, Mridul, Samyak Jain +7 · 1 citation
Computer Science · #Advanced Graph Neural Networks #Artificial Intelligence (cs.AI) #FOS: Computer and information sciences #Machine Learning (cs.LG) #Machine Learning and ELM