Stars
A generative and self-guided robotic agent that endlessly propose and master new skills.
A generative world for general-purpose robotics & embodied AI learning.
An extremely fast Python package and project manager, written in Rust.
Intelligent Artificial Life. Researching behavior by nature and nurture simulation, deploying multi-agent reinforcement learning and evolving generational inheritance.
A demo set of programming assignments developed using Q# and Azure Quantum Development Kit
Quickly build Explainable AI dashboards that show the inner workings of so-called "blackbox" machine learning models.
Message Passing Neural Networks for Molecule Property Prediction
yunsiechung / chemprop
Forked from chemprop/chempropMessage Passing Neural Networks for Molecule Property Prediction
Implementation of the paper "Neuraldecipher - Reverse-engineering extended-connectivity fingerprints (ECFPs) to their molecular structures" by Tuan Le, Robin Winter, Frank Noé and Djork-Arné Clevert
Public development project of the LAMMPS MD software package
A collection of research papers, datasets and software related to knowledge graphs for drug discovery. Accompanies the paper "A review of biomedical datasets relating to drug discovery: a knowledge…
PyTorch implementation of the LEAF audio frontend
LEAF is a learnable alternative to audio features such as mel-filterbanks, that can be initialized as an approximation of mel-filterbanks, and then be trained for the task at hand, while using a ve…
Responsible AI Toolbox is a suite of tools providing model and data exploration and assessment user interfaces and libraries that enable a better understanding of AI systems. These interfaces and l…
Example code from the book "Deep Learning for the Life Sciences"
Democratizing Deep-Learning for Drug Discovery, Quantum Chemistry, Materials Science and Biology
Deep Reinforcement Learning for de-novo Drug Design
OpenChem: Deep Learning toolkit for Computational Chemistry and Drug Design Research
A curated list of practical guide resources of LLMs (LLMs Tree, Examples, Papers)
Tool for producing high quality forecasts for time series data that has multiple seasonality with linear or non-linear growth.
For IBM Quantum Fall Challenge 2022
For IBM Quantum Challenge Fall 2021