Project Name | Stars | Downloads | Repos Using This | Packages Using This | Most Recent Commit | Total Releases | Latest Release | Open Issues | License | Language |
---|---|---|---|---|---|---|---|---|---|---|
Moses | 730 | 5 months ago | 26 | mit | Python | |||||
Molecular Sets (MOSES): A Benchmarking Platform for Molecular Generation Models | ||||||||||
Geodiff | 211 | a year ago | 9 | mit | Python | |||||
Implementation of GeoDiff: a Geometric Diffusion Model for Molecular Conformation Generation (ICLR 2022). | ||||||||||
Stoned Selfies | 99 | 9 months ago | 2 | Jupyter Notebook | ||||||
This repository contains code for the paper: Beyond Generative Models: Superfast Traversal, Optimization, Novelty, Exploration and Discovery (STONED) Algorithm for Molecules using SELFIES | ||||||||||
Fcd | 58 | 1 | 1 | 8 months ago | 3 | August 23, 2023 | lgpl-3.0 | Python | ||
Fréchet ChemNet Distance: A quality measure for generative models for molecules | ||||||||||
Fragment Based Dgm | 46 | a year ago | 2 | Python | ||||||
Code for the paper "A Deep Generative Model for Fragment-Based Molecule Generation" (AISTATS 2020) | ||||||||||
Graph Nvp | 44 | 5 years ago | 1 | mit | Python | |||||
GraphNVP: An Invertible Flow Model for Generating Molecular Graphs | ||||||||||
Ligdream | 34 | 4 years ago | 2 | agpl-3.0 | Jupyter Notebook | |||||
Novel molecules from a reference shape! | ||||||||||
Cvae | 30 | 4 years ago | Python | |||||||
github for "Molecular generative model based on conditional variational autoencoder for de novo molecular design" | ||||||||||
Coarse Graining Auto Encoders | 21 | 2 years ago | Jupyter Notebook | |||||||
Reinvent Randomized | 20 | 4 years ago | 1 | mit | Python | |||||
Recurrent Neural Network using randomized SMILES strings to generate molecules |