Python equivariance

Open-source Python projects categorized as equivariance
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Topics: drug-design graph-neural-networks Machine Learning generative-model Pytorch
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Top 4 Python equivariance Projects

  • e2cnn

    E(2)-Equivariant CNNs Library for Pytorch

  • EquiBind

    EquiBind: geometric deep learning for fast predictions of the 3D structure in which a small molecule binds to a protein

  • InfluxDB

    Power Real-Time Data Analytics at Scale. Get real-time insights from all types of time series data with InfluxDB. Ingest, query, and analyze billions of data points in real-time with unbounded cardinality.

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  • DiffSBDD

    A Euclidean diffusion model for structure-based drug design.

  • DiffLinker

    DiffLinker: Equivariant 3D-Conditional Diffusion Model for Molecular Linker Design

NOTE: The open source projects on this list are ordered by number of github stars. The number of mentions indicates repo mentiontions in the last 12 Months or since we started tracking (Dec 2020).

Python equivariance related posts

  • A Program to Build E(N)-Equivariant Steerable CNNs - Link to a free online lecture by the author in comments

    1 project | /r/learnmachinelearning | 23 Feb 2022

Index

What are some of the best open-source equivariance projects in Python? This list will help you:

Project Stars
1 e2cnn 582
2 EquiBind 452
3 DiffSBDD 290
4 DiffLinker 247

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