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Reflection-Equivariant Diffusion for 3D Structure Determination from
  Isotopologue Rotational Spectra in Natural Abundance

Reflection-Equivariant Diffusion for 3D Structure Determination from Isotopologue Rotational Spectra in Natural Abundance

17 October 2023
Austin H. Cheng
Alston Lo
Santiago Miret
Brooks H Pate
Alán Aspuru-Guzik
ArXivPDFHTML

Papers citing "Reflection-Equivariant Diffusion for 3D Structure Determination from Isotopologue Rotational Spectra in Natural Abundance"

4 / 4 papers shown
Title
Geometric Latent Diffusion Models for 3D Molecule Generation
Geometric Latent Diffusion Models for 3D Molecule Generation
Minkai Xu
Alexander Powers
R. Dror
Stefano Ermon
J. Leskovec
DiffM
AI4CE
45
131
0
02 May 2023
ResiDual: Transformer with Dual Residual Connections
ResiDual: Transformer with Dual Residual Connections
Shufang Xie
Huishuai Zhang
Junliang Guo
Xu Tan
Jiang Bian
Hany Awadalla
Arul Menezes
Tao Qin
Rui Yan
43
18
0
28 Apr 2023
DiffDock: Diffusion Steps, Twists, and Turns for Molecular Docking
DiffDock: Diffusion Steps, Twists, and Turns for Molecular Docking
Gabriele Corso
Hannes Stärk
Bowen Jing
Regina Barzilay
Tommi Jaakkola
DiffM
130
399
0
04 Oct 2022
Frame Averaging for Invariant and Equivariant Network Design
Frame Averaging for Invariant and Equivariant Network Design
Omri Puny
Matan Atzmon
Heli Ben-Hamu
Ishan Misra
Aditya Grover
Edward James Smith
Y. Lipman
FedML
33
90
0
07 Oct 2021
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