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? A Collection of Awesome Large Weather Models (LWMs) | AI for Earth (AI4Earth) | AI for Science (AI4Science)
Automated Hypothesis Testing with Agentic Sequential Falsifications
DrugAssist: A Large Language Model for Molecule Optimization
Fork of E3SM used to develop exascale global atmosphere model written in C++ (aka SCREAM)
Graph Learning with Generative Pretrained Transformers
SC23 Deep Learning at Scale Tutorial Material
[NeurIPS 24] Probablistic Emulation of a Global Climate Model with Spherical DYffusion
[NeurIPS 2024] Physics-Informed Regularization for Domain-Agnostic Dynamical System Modeling
A deep neural network with hybrid architecture (EGNN + Transformer) for molecular properties prediction.
Official PyTorch implementation of PTS/PSRN: Fast and efficient symbolic expression discovery through parallelized tree search. Evaluates millions of expressions simultaneously on GPU with automated subtree reuse.
Performance Estimates for Transformer AI Models in Science