Table 1 Comparison of qubit counts for Jordan-Wigner encoding and qubit-efficient encoding for the tautomers of acetone and Edaravone.
From: Quantum simulation of preferred tautomeric state prediction
Molecule | Active Space Orbitals | (Electrons, MO) | JW Qubit Count | QEE Qubit Count |
|---|---|---|---|---|
acetone | 14-19 | (4e, 6o) | 12 | 8 |
propen-2-ol | 14-19 | (4e, 6o) | 12 | 8 |
Edaravone (keto) | 44-49 | (4e, 6o) | 12 | 8 |
Edaravone (enol) | 44-49 | (4e, 6o) | 12 | 8 |
Edaravone (amine) | 44-49 | (4e, 6o) | 12 | 8 |
