LUFFY framework links molecular structure to electrostatic response and stable information transfer in MolFCN by combining conformational sampling, VACT extraction, and ab initio validation on 27 candidate molecules.
9 Figure 12: Neutral molecules electrostatic response underEck
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Toward the Rational Design of Molecular Field-Coupled Nanocomputing Candidates
LUFFY framework links molecular structure to electrostatic response and stable information transfer in MolFCN by combining conformational sampling, VACT extraction, and ab initio validation on 27 candidate molecules.