reacnetgenerator

QMzyme

QM-based enzyme model generation and validation.

eg3d

rater

rater, recommender systems. 推荐模型，包括：DeepFM，Wide&Deep，DIN，DeepWalk，Node2Vec等模型实现，开箱即用。

MatchZoo

Facilitating the design, comparison and sharing of deep text matching models.

deepchem

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

aescore

Learning Protein-Ligand Affinity with Atomic Environment Vectors

CenterNet

Object detection, 3D detection, and pose estimation using center point detection:

deepmd-kit

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

EasyRec

A framework for large scale recommendation algorithms.

deep_architecture_genealogy

Deep Learning Architecture Genealogy Project

DeepCTR

Easy-to-use,Modular and Extendible package of deep-learning based CTR models .

dgl

Python package built to ease deep learning on graph, on top of existing DL frameworks.

robert

Automated machine learning protocols that start from CSV databases of descriptors or SMILES and p...