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Xinhao Li's Projects

aidm-2020-posters icon aidm-2020-posters

Accepted Posters to present at the MIT's AI-powered Drug Discovery and Manufacturing Conference 2020.

blog icon blog

A blog website powered by Fastpages

bokeh icon bokeh

Interactive Data Visualization in the browser, from Python

cduvallet.github.io icon cduvallet.github.io

Github Pages template for academic personal websites, forked from mmistakes/minimal-mistakes

mat icon mat

The official implementation of the Molecule Attention Transformer.

mol2vec icon mol2vec

Mol2vec - an unsupervised machine learning approach to learn vector representations of molecular substructures

molds icon molds

A collection of molecule datasets for benchmarking machine learning methods.

moses icon moses

Molecular Sets (MOSES): A Benchmarking Platform for Molecular Generation Models

notebook_to_scrpit icon notebook_to_scrpit

My attempt at reproducing the paper Deep Autoencoding Gaussian Mixture Model for Unsupervised Anomaly Detection

smilespe icon smilespe

SMILES Pair Encoding: A data-driven substructure representation of chemicals

tokenizers icon tokenizers

💥Fast State-of-the-Art Tokenizers optimized for Research and Production

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