DingQK

DingQK

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Company:Peking University

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graph-rec

Senior Capstone Project: Graph-Based Product Recommendation

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pai

Resource scheduling and cluster management for AI

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biopandas

Working with molecular structures in pandas DataFrames

Language:PythonLicense:BSD-3-ClauseStargazers:710Issues:0Issues:0

TDC

Therapeutics Commons (TDC-2): Multimodal Foundation for Therapeutic Science

Language:Jupyter NotebookLicense:MITStargazers:992Issues:0Issues:0

pandas

Flexible and powerful data analysis / manipulation library for Python, providing labeled data structures similar to R data.frame objects, statistical functions, and much more

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ogb

Benchmark datasets, data loaders, and evaluators for graph machine learning

Language:PythonLicense:MITStargazers:1932Issues:0Issues:0

chembl_webresource_client

Official Python client for accessing ChEMBL API

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deepchem

Democratizing Deep-Learning for Drug Discovery, Quantum Chemistry, Materials Science and Biology

Language:PythonLicense:MITStargazers:5442Issues:0Issues:0

gensim

Topic Modelling for Humans

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word2vec

Python interface to Google word2vec

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pymilvus

Python SDK for Milvus.

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stellargraph

StellarGraph - Machine Learning on Graphs

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benchmarking-gnns

Repository for benchmarking graph neural networks

Language:Jupyter NotebookLicense:MITStargazers:2502Issues:0Issues:0

hgraph2graph

Hierarchical Generation of Molecular Graphs using Structural Motifs

Language:PythonLicense:MITStargazers:373Issues:0Issues:0

icml18-jtnn

Junction Tree Variational Autoencoder for Molecular Graph Generation (ICML 2018)

Language:PythonLicense:MITStargazers:510Issues:0Issues:0

milvus

A cloud-native vector database, storage for next generation AI applications

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abacus-develop

An electronic structure package based on either plane wave basis or numerical atomic orbitals.

Language:C++License:LGPL-3.0Stargazers:169Issues:0Issues:0

deepmd-kit

A deep learning package for many-body potential energy representation and molecular dynamics

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community

DeepModeling community content

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