RussWolfinger

RussWolfinger

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streamlit_prophet

Streamlit app to train, evaluate and optimize a Prophet forecasting model.

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zeta

Build high-performance AI models with modular building blocks

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Jamba

PyTorch Implementation of Jamba: "Jamba: A Hybrid Transformer-Mamba Language Model"

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mamba

Mamba SSM architecture

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pytorch_tabular

A standard framework for modelling Deep Learning Models for tabular data

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RUL

Transformer Network for Remaining Useful Life Prediction of Lithium-Ion Batteries

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Li-ion-Battery-Prognosis-Based-on-Hybrid-Bayesian-PINN

Code used to generate the results of the paper: Nascimento et al. A framework for Li-ion battery prognosis based on hybrid Bayesian physics-informed neural networks.

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DNN-DRT

Deconvolution of electrochemical impedance spectroscopy data using the deep-neural-network-enhanced distribution of relaxation times

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torch-hlm

Hierarchical mixed-effects models in pytorch

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strong-glm

Fit generalized linear models using PyTorch

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pykan

Kolmogorov Arnold Networks

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torchkan

An easy to use PyTorch implementation of the Kolmogorov Arnold Network and a few novel variations

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pynndescent

A Python nearest neighbor descent for approximate nearest neighbors

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umap_pytorch

Pytorch port for Parametric Umap

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reinvent-randomized

Recurrent Neural Network using randomized SMILES strings to generate molecules

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ogb

Benchmark datasets, data loaders, and evaluators for graph machine learning

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kineto

A CPU+GPU Profiling library that provides access to timeline traces and hardware performance counters.

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pytorch_scatter

PyTorch Extension Library of Optimized Scatter Operations

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pyg_chemprop

A concise and easy-to-customize reimplementation of "ChemProp" (Yang et al, 2019) in PyTorch Geometric.

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rdkit

The official sources for the RDKit library

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polyBERT

polyBERT: A chemical language model to enable fully machine-driven ultrafast polymer informatics

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bert-loves-chemistry

bert-loves-chemistry: a repository of HuggingFace models applied on chemical SMILES data for drug design, chemical modelling, etc.

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molformer

Repository for MolFormer

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LLM_Fine_Tuning_Molecular_Properties

Fine-tuning of ChemBERTA LLMs to predict molecules' HIV inhibition replication.

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chemprop

Message Passing Neural Networks for Molecule Property Prediction

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LibtorchSegmentation

A c++ trainable semantic segmentation library based on libtorch (pytorch c++). Backbone: VGG, ResNet, ResNext. Architecture: FPN, U-Net, PAN, LinkNet, PSPNet, DeepLab-V3, DeepLab-V3+ by now.

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