Molecule_bond_prediction

Predict scalar coupling in molecules
Alternatives To Molecule_bond_prediction
Project NameStarsDownloadsRepos Using ThisPackages Using ThisMost Recent CommitTotal ReleasesLatest ReleaseOpen IssuesLicenseLanguage
Chemprop1,405
5 months ago13August 01, 202361otherPython
Message Passing Neural Networks for Molecule Property Prediction
Tdc88946 months ago32January 27, 202334mitJupyter Notebook
Therapeutics Data Commons: Artificial Intelligence Foundation for Therapeutic Science
Moses730
7 months ago26mitPython
Molecular Sets (MOSES): A Benchmarking Platform for Molecular Generation Models
Megnet444
a year ago21bsd-3-clauseJupyter Notebook
Graph Networks as a Universal Machine Learning Framework for Molecules and Crystals
Tensormol190
6 years ago1November 08, 201716gpl-3.0Python
Tensorflow + Molecules = TensorMol
Moleculekit18316 months ago187January 10, 20249otherPython
MoleculeKit: Your favorite molecule manipulation kit
Torsional Diffusion183
9 months ago6mitPython
Implementation of Torsional Diffusion for Molecular Conformer Generation (NeurIPS 2022)
Awesome Chemistry Datasets150
7 months ago17cc0-1.0
overview of datasets for ML in chemistry
Gcnn_keras9425 months ago26November 29, 202310mitJupyter Notebook
Graph convolutions in Keras with TensorFlow, PyTorch or Jax.
Neuralogic84
7 months ago2February 23, 2022mitJava
Deep relational learning through differentiable logic programming.
Alternatives To Molecule_bond_prediction
Select To Compare


Alternative Project Comparisons
Popular Molecule Projects
Popular Machine Learning Projects
Popular Science Categories
Related Searches

Get A Weekly Email With Trending Projects For These Categories
No Spam. Unsubscribe easily at any time.
Python
Machine Learning
Data Analysis
Kaggle
Molecule