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AdaTask: A Task-Aware Adaptive Learning Rate Approach to Multi-Task Learning. AAAI, 2023.

Python 24 1 Updated Sep 29, 2023

💬 OpenAI Assistants API chat UI 🛠️ It works easily by setting the ASSISTANT ID 📁 Supports file upload and file download 🏃 Supports Streaming API 🪟 Support to Azure OpenAI

Python 226 184 Updated Sep 23, 2024

Democratizing Deep-Learning for Drug Discovery, Quantum Chemistry, Materials Science and Biology

Python 5,676 1,726 Updated Jan 17, 2025

Supporting code for the paper "Discovery of a structural class of antibiotics with explainable deep learning"

Jupyter Notebook 88 14 Updated Oct 14, 2023

Personal branch of chemprop used to predict the antibiotics Abaucin

Python 26 8 Updated May 25, 2023

Local homology search powered by ESM-2 language model, foldseek, hhsuite, and hmmer.

Jupyter Notebook 13 Updated Jan 14, 2025

Transformers for Information Retrieval, Text Classification, NER, QA, Language Modelling, Language Generation, T5, Multi-Modal, and Conversational AI

Python 4,137 723 Updated May 29, 2024

CLIP (Contrastive Language-Image Pretraining), Predict the most relevant text snippet given an image

Jupyter Notebook 26,993 3,407 Updated Jul 23, 2024

[ICLR 2023] One Transformer Can Understand Both 2D & 3D Molecular Data (official implementation)

Python 207 26 Updated Mar 31, 2023

code repo for Set2Gaussian

Python 15 3 Updated Jun 19, 2020

CLEAN: a contrastive learning model for high-quality functional prediction of proteins

Python 241 47 Updated Jul 27, 2024

Evolutionary couplings from protein and RNA sequence alignments

Jupyter Notebook 251 75 Updated Dec 3, 2024

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

Jupyter Notebook 424 64 Updated Oct 27, 2024

The official sources for the RDKit library

HTML 2,755 896 Updated Jan 17, 2025

Repository for MolFormer

Jupyter Notebook 280 44 Updated Oct 16, 2023

Message Passing Neural Networks for Molecule Property Prediction

Python 1,855 600 Updated Jan 15, 2025

Making large AI models cheaper, faster and more accessible

Python 39,015 4,353 Updated Jan 8, 2025

Meta learning addresses noisy and under-labeled data in machine learning-guided antibody engineering (https://doi.org/10.1016/j.cels.2023.12.003)

Python 20 3 Updated Aug 8, 2024

PyTorch Implementation of Physics-informed Neural Networks

Jupyter Notebook 566 135 Updated May 20, 2024

Simple PyTorch Implementation of Physics Informed Neural Network (PINN)

Jupyter Notebook 274 50 Updated Jul 5, 2024

code for the paper "Few-Shot Regression via Learning Sparsifying Basis Functions

Python 17 4 Updated Sep 28, 2019

Official pytorch implementation of the paper "Bayesian Meta-Learning for the Few-Shot Setting via Deep Kernels" (NeurIPS 2020)

Python 202 30 Updated Jan 19, 2022

RXN for biochemical reactions

Python 65 14 Updated Oct 18, 2022

A library for efficient similarity search and clustering of dense vectors.

C++ 32,420 3,705 Updated Jan 15, 2025

Deep networks for protein functional inference

Jupyter Notebook 164 28 Updated Oct 25, 2024

A generative latent variable model for biological sequence families.

Python 210 45 Updated Mar 15, 2022

Mutation effects predicted from sequence co-variation

HTML 61 13 Updated Sep 3, 2017

MMseqs2: ultra fast and sensitive search and clustering suite

C 1,515 206 Updated Jan 17, 2025
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