alexarnimueller

Alex Müller's repositories

som

Self organizing Kohonen map in Python with periodic boundary conditions

Language:PythonNOASSERTION134 4 8

LSTM_peptides

Long short-term memory recurrent neural networks for learning peptide and protein sequences to later design new, similar examples.

Language:PythonNOASSERTION71 5 6

modlAMP

Python package for peptide sequence generation, peptide descriptor calculation and sequence analysis.

Language:PythonNOASSERTION49 5 13

SMILES_generator

Generative RNN for molecule de novo design

Language:Python15 1 1

surf

Simple User-Friendly Reaction Format

Language:PythonMIT14 1 3

cats-descriptor

Python implementation of the CATS molecular descriptor

Language:PythonMIT6 2 2

aoc_2022

Advent of Code 2022

Language:PythonMIT1 10

coffee-pi

A Raspberry Pi modification to the Rancilio Silvia Espresso Machine implementing PID temperature control.

Language:PythonMIT1 30

structurebased

Repository containing scripts for docking with Vina

Language:ShellMIT1 20

alexarnimueller

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audio-pi

repo for creating a simple audioplayer using a raspberry pi

Language:Python010

audio_tokens

This is a Javascript toolbox to perform online rating studies with auditory material.

Language:JavaScript000

effgee

Functional group mapping using the RDKit

Language:Jupyter NotebookBSD-2-Clause010

erikas

erikas.ch website

Language:JavaScript010

erikas-secret

Website für Erikas Secret Projekt

Language:Python010

fdd

FdD website

Language:HTML010

g-plip

Repository for G-PLIP (paper "Knowledge graph neural network for structure-free protein-ligand affinity prediction")

Language:PythonNOASSERTION000

kraken-dca

Dollar-Cost Averaging bot for cryptocurrency pairs on Kraken exchange.

Language:PythonGPL-3.0000

learning-jax

learning how to use jax, flax, optax etc.

Language:Python010

MolGAN

Tensorflow implementation of MolGAN: An implicit generative model for small molecular graphs (https://arxiv.org/abs/1805.11973)

Language:PythonMIT010

ord-play

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REINVENT

Molecular De Novo design using Recurrent Neural Networks and Reinforcement Learning

Language:PythonMIT010

retrosynthesis

Applying deep neural networks for retrosynthesis tasks

Language:Python010

smiles-transformer

Original implementation of the paper "SMILES Transformer: Pre-trained Molecular Fingerprint for Low Data Drug Discovery" by Shion Honda et al.

Language:Jupyter NotebookMIT010

stable-diffusion

Language:Python010

strava

analyzing my strava activities

020

strava-heatmap

personal strava heatmap

Language:JavaScript020

transformer-cnn

Transformer CNN for QSAR/QSPR modelling

Language:Python010

tschugger

flamberg tschugger Anmeldung

Language:Python010

upptime

my own upptime

Language:MarkdownMIT000