Alex Müller's repositories
LSTM_peptides
Long short-term memory recurrent neural networks for learning peptide and protein sequences to later design new, similar examples.
SMILES_generator
Generative RNN for molecule de novo design
cats-descriptor
Python implementation of the CATS molecular descriptor
structurebased
Repository containing scripts for docking with Vina
audio_tokens
This is a Javascript toolbox to perform online rating studies with auditory material.
erikas-secret
Website für Erikas Secret Projekt
g-plip
Repository for G-PLIP (paper "Knowledge graph neural network for structure-free protein-ligand affinity prediction")
kraken-dca
Dollar-Cost Averaging bot for cryptocurrency pairs on Kraken exchange.
learning-jax
learning how to use jax, flax, optax etc.
retrosynthesis
Applying deep neural networks for retrosynthesis tasks
smiles-transformer
Original implementation of the paper "SMILES Transformer: Pre-trained Molecular Fingerprint for Low Data Drug Discovery" by Shion Honda et al.
strava-heatmap
personal strava heatmap
transformer-cnn
Transformer CNN for QSAR/QSPR modelling
upptime
my own upptime