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Graph-To-Structure: Prediction of molecular structures, transition-states and solids from graphs
Graph-To-Structure: Prediction of molecular structures, transition-states and solids from graphs
2021
Dominik Lemm
Guido Falk von Rudorff
O. Anatole von Lilienfeld
Keywords:
Structure (category theory)
Graph
Combinatorics
Transition state
Mathematics
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