Project Name	Stars	Packages Using This	Most Recent Commit	Total Releases	Latest Release	Open Issues	License	Language
Chemprop	1,405		3 months ago	13	August 01, 2023	61	other	Python
Message Passing Neural Networks for Molecule Property Prediction
Dgl Lifesci	558	4	a year ago	17	December 21, 2022	25	apache-2.0	Python
Python package for graph neural networks in chemistry and biology
Graphinvent	312		a year ago			10	mit	Python
Graph neural networks for molecular design.
Tensormol	190		6 years ago	1	November 08, 2017	16	gpl-3.0	Python
Tensorflow + Molecules = TensorMol
Gcnn_keras	94	2	3 months ago	26	November 29, 2023	10	mit	Jupyter Notebook
Graph convolutions in Keras with TensorFlow, PyTorch or Jax.
Neuralogic	84		4 months ago	2	February 23, 2022		mit	Java
Deep relational learning through differentiable logic programming.
Deep Drug Coder	75		3 years ago			1	mit	Python
A tensorflow.keras generative neural network for de novo drug design, published in Nature Machine Intelligence while working at AstraZeneca.
Simple Equivariant Gnn	59		2 years ago			2	apache-2.0	Python
A short and easy PyTorch implementation of E(n) Equivariant Graph Neural Networks
Drugai	56		5 years ago					Python
Generation and Classification of Drug Like molecule usings Neural Networks
Graph Nvp	44		5 years ago			1	mit	Python
GraphNVP: An Invertible Flow Model for Generating Molecular Graphs

Alternatives To Chemprop

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Chemprop ⭐ 1,405

Message Passing Neural Networks for Molecule Property Prediction

total releases 13most recent commit 3 months ago

Dgl Lifesci ⭐ 558

Python package for graph neural networks in chemistry and biology

dependent packages 4total releases 17most recent commit a year ago

Graphinvent ⭐ 312

Graph neural networks for molecular design.

most recent commit a year ago

Tensormol ⭐ 190

Tensorflow + Molecules = TensorMol

total releases 1most recent commit 6 years ago

Gcnn_keras ⭐ 94

Graph convolutions in Keras with TensorFlow, PyTorch or Jax.

dependent packages 2total releases 26most recent commit 3 months ago

Neuralogic ⭐ 84

Deep relational learning through differentiable logic programming.

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Deep Drug Coder ⭐ 75

A tensorflow.keras generative neural network for de novo drug design, published in Nature Machine Intelligence while working at AstraZeneca.

most recent commit 3 years ago

Simple Equivariant Gnn ⭐ 59

A short and easy PyTorch implementation of E(n) Equivariant Graph Neural Networks

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Drugai ⭐ 56

Generation and Classification of Drug Like molecule usings Neural Networks

most recent commit 5 years ago

Graph Nvp ⭐ 44

GraphNVP: An Invertible Flow Model for Generating Molecular Graphs

most recent commit 5 years ago

Suggest An Alternative To chemprop

Alternative Project Comparisons

Chemprop vs Dgl Lifesci

Chemprop vs Graphinvent

Chemprop vs Tensormol

Chemprop vs Gcnn_keras

Chemprop vs Neuralogic

Chemprop vs Deep Drug Coder

Chemprop vs Simple Equivariant Gnn

Chemprop vs Drugai

Chemprop vs Graph Nvp

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