/tools/CGCF-ConfGen
CGCF-ConfGen
MinkaiXu/CGCF-ConfGen
46 stars16 forksPythonAdded February 8, 2026
summary
CGCF-ConfGen is a tool for generating molecular conformations using neural generative dynamics. It allows users to train models and generate multiple conformations for molecules, making it useful for molecular design and optimization tasks.
description
:test_tube: Learning Neural Generative Dynamics for Molecular Conformation Generation (ICLR 2021)
topics
moleculeconformation-generationiclriclr2021conformerconformationpytorch
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