conformation topic
List
conformation repositories
GeoDiff
302
Stars
68
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Implementation of GeoDiff: a Geometric Diffusion Model for Molecular Conformation Generation (ICLR 2022).
CGCF-ConfGen
44
Stars
16
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:test_tube: Learning Neural Generative Dynamics for Molecular Conformation Generation (ICLR 2021)
ConfVAE-ICML21
50
Stars
16
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An End-to-End Framework for Molecular Conformation Generation via Bilevel Programming (ICML'21)
MoleculeSDE
29
Stars
2
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A Group Symmetric Stochastic Differential Equation Model for Molecule Multi-modal Pretraining, ICML'23