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3d-structures

Here are 2 public repositories matching this topic...

chao1224 / Geom3D

Geom3D: Geometric Modeling on 3D Structures, NeurIPS 2023

material chemistry geometry biology proteins physics drugs group symmetry molecules 3d crystals invariance equivariance 3d-structures ai4science

Updated Jun 5, 2024
Python

patonlab / CASCADE

CAlculation of NMR Chemical Shifts using Deep LEarning

deep-neural-networks calculate-chemical-shifts nmr-chemical-shifts 3d-structures

Updated Mar 27, 2023
JavaScript

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