Irzos's Stars
kenjihiranabe/The-Art-of-Linear-Algebra
Graphic notes on Gilbert Strang's "Linear Algebra for Everyone"
deepchem/deepchem
Democratizing Deep-Learning for Drug Discovery, Quantum Chemistry, Materials Science and Biology
danielegrattarola/spektral
Graph Neural Networks with Keras and Tensorflow 2.
NX-AI/xlstm
Official repository of the xLSTM.
HIPS/neural-fingerprint
Convolutional nets which can take molecular graphs of arbitrary size as input.
muditbhargava66/PyxLSTM
Efficient Python library for Extended LSTM with exponential gating, memory mixing, and matrix memory for superior sequence modeling.
dhimmel/drugbank
User-friendly extensions of the DrugBank database
kexinhuang12345/MolTrans
MolTrans: Molecular Interaction Transformer for Drug Target Interaction Prediction (Bioinformatics)
KrishnaswamyLab/ReLSO-Guided-Generative-Protein-Design-using-Regularized-Transformers
a Transformer-based neural network for generating highly optimized protein sequences called Regularized Latent Space Optimization (RELSO)
ropensci/dbparser
Source code for the R package, "dbparser" (i.e. DrugBank Parser)
lifanchen-simm/transformerCPI2.0
Sequence-to-drug concept adds a perspective on drug design. It can serve as an alternative method to SBDD, particularly for proteins that do not yet have high-quality 3D structures available.
cthoyt/drugbank_downloader
Don't worry about DrugBank licensing - write code that knows how to download it automatically
luoyunan/KDBNet
Kinase–drug binding prediction with calibrated uncertainty quantification
styalai/xLSTM-pytorch
A easy to use implementation of xLSTM
zhangpl109/DeepMGT-DTI
interstellar-Consultation-Services/dbdataset
DrugBank dataset files in R dataframes
changecool/Target-Prediction-Crawler
This crawler can automatically crawl the target information of various molecular targets prediction websites, including SwissTargetPrediction, SEA, and SuperPred database. It achieves automatic screening and standardization of gene names.
ltorres97/FS-GNNConv
Few-Shot Learning via Graph Embeddings with Convolutional Networks for Low-Data Molecular Property Prediction
qiwang067/awesome-xlstm
A curated list of xLSTM resources
Ali01552/DrugBank-Scrap
This Python script utilizes `asyncio` to scrape drug data from DrugBank and saves it to a CSV file.
UYousafzai/llm_xlstm
resources for training xlstm based llms, this repo may include: dataloaders, model architectures, training code.
KoslickiLab/DrugBankNER
ETL of DrugBank to recognize KG2 concepts in DrugBank entries for use as training data