This is your work, valued
PI: Markus J. Buehler, MIT Our research focus on developing a new paradigm that designs materials from the molecular scale, using MD, ML and other methods
PDF2Audio. Jupyter Notebook
1.4kSciAgentsDiscovery. Python
624GraphReasoning. Jupyter Notebook
299PRefLexOR. Preference-based Recursive Language Modeling for Exploratory Optimization of Reasoning
244AtomAgents. Forth
99HyperGraphReasoning. HTML
85MeLM. Jupyter Notebook
73Graph-Aware-Transformers. Graph-Aware Attention for Adaptive Dynamics in Transformers
70LifeGPT. Jupyter Notebook
69ModeShapeDiffusionDesign. Jupyter Notebook
53ProtAgents. Jupyter Notebook
51MechAgents. Agent-based LLM modeling of mechanics problems
46ProteinDiffusionGenerator. Generative method to design novel proteins using a diffusion model
43FieldPredictorGAN. Deep learning model to predict complex stress and strain fields in hierarchical composites
31LLM-finetuning. Python
31HierarchicalDesign. A computational building block approach towards multiscale architected materials analysis and design with application to hierarchical metal metamaterials
28ProteinMechanicsDiffusionDesign. Jupyter Notebook
27Sparks. Multi-modal, multi-agent AI system capable of independently conducting research by formulating hypotheses, performing experiments, and adapting its strategy
22MoleculeDiffusionTransformer. Molecular generation using diffusion models and autoregressive transformer models
21FieldCompleter. GAN/convolutional and Transformer models to predict missing mechanical information given limited known data in part of the domain, and further characterize the composite geometries from the recovered mechanical fields for 2D and 3D complex microstructures
20Cephalo-Phi-3-Vision-MoE. Python
17MateriomicTransformer. Generative Pretrained Autoregressive Transformer Graph Neural Network applied to the Analysis and Discovery of Materials
16atomic2field. Codes for translating structural defects to atomic properties
15DynaGen. The DynaGen model allows the prediction of dynamical field data based on microstructure input. The model is exemplified to dynamic fracture problems in brittle materials.
12Cephalo. Jupyter Notebook
12PeptideMiner. Jupyter Notebook
12ProteinSwarm. Python
12LeafGAN. Jupyter Notebook
10SilkomeGPT. Generative strategies for modeling, design and analysis of silk protein sequences for enhanced mechanical properties
9GraphGeneration. GraphGeneration: Modeling and design of hierarchical bio-inspired de novo spider web structures using deep learning and additive manufacturing
9DyFraNet. Jupyter Notebook
8CollagenTransformer. CollagenTransformer: End-to-End Transformer Model to Predict Thermal Stability of Collagen Triple Helices Using an NLP Approach
8BEAVER. Python
8LLMsxPlants. Jupyter Notebook
6SparksMatter. Python
6graph-preflexor-grpo. Jupyter Notebook
5MusicAnalysis. Music analysis tools especially around scales, defects and related topics
5AttentionCrossTranslation. Unsupervised cross-domain translation via deep learning and adversarial attention neural networks and application to music-inspired protein designs
4MolShapeGAN. Jupyter Notebook
4SilkomeMD. Shell
3marker. Convert PDF to markdown quickly with high accuracy
3Falcon-Programming-Language. The Falcon Programming Language.
3ProteinMechanicsGNN. Rapid Prediction of Protein Natural Frequencies using Graph Neural Networks
2SpiderPDB. PDB files of spider silk structures
2Cephalo-Idefics2-MoE. Python
2MNNN. Python
2InstantMesh. InstantMesh: Efficient 3D Mesh Generation from a Single Image with Sparse-view Large Reconstruction Models
1FieldPerceiver. Field-to-field translation
1GenerativeDiffusionImages. Jupyter Notebook
1mergekit-Phi3-V. Tools for merging pretrained large language models.
1fast-perceiver. Fast and memory efficient PyTorch implementation of the Perceiver with FlashAttention.
1InterPLM. Discovering Interpretable Features in Protein Language Models via Sparse Autoencoders
1GNN-collective-cell-dynamics. Python
1imagen-pytorch. Implementation of Imagen, Google's Text-to-Image Neural Network, in Pytorch
1HardnessMapDesign. Jupyter Notebook
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