conftrace_

electronic density

2 papers

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Co-occurring keywords · papers mentioning both

se3-equivariant neural network (1) solid harmonic wavelet (1) quantum molecular energy (1) rigid motion invariance (1) molecular wavefunction (1) multilinear regression (1) wavelet scattering transform (1) wavefunction prediction (1) point cloud processing (1) quantum chemistry (1)

Papers

SE(3)-equivariant prediction of molecular wavefunctions and electronic densities NeurIPS 2021 Solid Harmonic Wavelet Scattering: Predicting Quantum Molecular Energy from Invariant Descriptors of 3D Electronic Densities NeurIPS 2017