An implementation of the Equivariant Graph Neural Network (EGNN) layer type for DGL-PyTorch.
☆15Dec 27, 2022Updated 3 years ago
Alternatives and similar repositories for EGNN-DGL
Users that are interested in EGNN-DGL are comparing it to the libraries listed below
Sorting:
- Final project for CS224W☆13Nov 7, 2022Updated 3 years ago
- Official implementation of HEGNN, a novel high-degree equivariant graph neural network proposed in the NeurIPS 2024 paper 'Are High-Degre…☆31Nov 8, 2024Updated last year
- Open Source Mycetoma's First Series of Molecules☆10Sep 22, 2025Updated 5 months ago
- A benchmark for comprehensive evaluation on protein structure tokenization methods☆44Aug 2, 2025Updated 7 months ago
- Autoencoder network for learning a continuous representation of molecular structures.☆28Nov 20, 2016Updated 9 years ago
- image stitching using superglue☆10Jul 12, 2024Updated last year
- Molecular Out-Of-Distribution☆39Apr 16, 2025Updated 10 months ago
- ☆34Jun 29, 2024Updated last year
- Metal Activity Heuristic of Metalloprotein and Enzymatic Sites (MAHOMES) - Predicts if a protein bound metal ion is enzymatic or non-enzy…☆11Apr 19, 2022Updated 3 years ago
- (Conditional) Normalizing Flows in PyTorch. Offers a wide range of (conditional) invertible neural networks.☆11Nov 28, 2024Updated last year
- ☆10Sep 9, 2023Updated 2 years ago
- Workshops on Computational Biology organized by our lab☆10Mar 25, 2024Updated last year
- Heroplan's Data☆14Feb 5, 2026Updated last month
- UartOscilloscope(Uart介面示波器)☆11Updated this week
- A collection of tools that generate and analyse side-chain rotamer libraries☆10Updated this week
- ☆14Dec 18, 2024Updated last year
- This package will help you perform a multiple minumum Monte Carlo conformer search as described in Chang et al., 1989. It is built to be …☆32Jan 22, 2026Updated last month
- Adding hydrogens to molecular models☆57Nov 24, 2025Updated 3 months ago
- Prose for a painting source code☆12Oct 8, 2019Updated 6 years ago
- A Prot paper related materials☆11Sep 5, 2022Updated 3 years ago
- A PyTorch implementation of SVGD (Stein Variational Gradient Descent), contains all examples including bayesian inference in the paper☆12Jul 30, 2020Updated 5 years ago
- Experimental approach to a modularized RVIZ2 that can run natively or in the browser☆10Jul 10, 2019Updated 6 years ago
- A Modular Architecture for Deep Learning Systems☆54May 23, 2025Updated 9 months ago
- Open source code for AlphaFold.☆12Nov 15, 2025Updated 3 months ago
- [ICML'25] The Price of Freedom: Exploring Expressivity and Runtime Tradeoffs in Equivariant Tensor Products☆17Jul 16, 2025Updated 7 months ago
- ☆11Jan 21, 2019Updated 7 years ago
- Helpful CMake modules - 3.0+☆12May 16, 2017Updated 8 years ago
- Notebook for standardization of actvity data, nonadditivity analysis and its evaluation.☆12Mar 16, 2023Updated 2 years ago
- AGCN - Spectral ChevNet built on Adaptive, trainable graphs☆12Aug 16, 2020Updated 5 years ago
- Emscripten port of libffi☆12Jun 21, 2023Updated 2 years ago
- ☆40Jan 16, 2026Updated last month
- Multicolor Metacity themes for Mate and Cinnamon DEs☆11Feb 17, 2017Updated 9 years ago
- ☆12Jul 3, 2021Updated 4 years ago
- A practical http client library for sending data to http servers.☆10Jul 10, 2024Updated last year
- DB-based Optical Chemical Structure Recognition☆12Sep 12, 2022Updated 3 years ago
- ☆12Mar 8, 2022Updated 3 years ago
- ☆11Oct 15, 2023Updated 2 years ago
- Taxi fare prediction using tensorflow probability☆15Jul 23, 2019Updated 6 years ago
- Contrastive learning of protein representations with graph neural networks for structural and functional annotations☆11Apr 23, 2023Updated 2 years ago