MatDagommer
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egnn-qm9 Public
Experimenting with E(3) Equivariant GNN for molecule property prediction.
Jupyter Notebook MIT License UpdatedFeb 13, 2025 -
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REINVENT4 Public
Forked from MolecularAI/REINVENT4AI molecular design tool for de novo design, scaffold hopping, R-group replacement, linker design and molecule optimization.
Python Apache License 2.0 UpdatedSep 25, 2024 -
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chemvae-torch Public
Pytorch implementation of ChemVAE (molecule generation framework).
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wine-classifier Public
Wine Classification using a Decision Tree Classifier.
MIT License UpdatedApr 25, 2024 -
tanimoto-dist Public
Computes Tanimoto distance between compounds.
Python MIT License UpdatedApr 23, 2024 -
mri-to-ct Public
Image-to-image deep learning framework for MRI to porosity map translation
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tandem-genomics Public
Forked from aymeric-degroote/tandem-genomicsCell Trajectory Inference based on RNA-seq and ATAC-seq
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moses Public
Forked from molecularsets/mosesMolecular Sets (MOSES): A Benchmarking Platform for Molecular Generation Models
Python MIT License UpdatedNov 20, 2023 -
WineQualityWorkshop Public
Forked from ZL090076/WineQualityWorkshopJupyter Notebook UpdatedAug 9, 2023 -
ddpm-mrs Public
Denoising Diffusion Probabilistic Model for MRS
Jupyter Notebook MIT License UpdatedMay 18, 2023 -
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vortex-simulation Public
Fluid Mechanics Project - Analysis of vortex emissions from an obstacle located in a 2D flow field - Karman Vortex Street
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earthquake-prediction Public
Deep Learning Project - Training models to predict incoming laboratory seisms based on acoustic sequences.
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molecular-dynamics Public
Computer Science Project - Simulation of gas particles with a solid sphere approximation in a 2D plane
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sleep-tracker Public
Physiology Project - Quantification of delta wave density during sleep