Skip to content
conftrace_

quantum mechanical energies

1 paper

Explore in graph

Co-occurring keywords · papers mentioning both

molecular machine learning (1) graph-like molecular data (1) atomization energy prediction (1) molecular geometry (1) atomization energy (1) graph-like data (1) molecular representation (1) invariant representation (1) molecular property prediction (1) molecular representation learning (1)

Papers

Learning Invariant Representations of Molecules for Atomization Energy Prediction NeurIPS 2012