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20232026
most citedQuantum Machine Learning in Drug Discovery: Applications in Academia and Pharmaceutical Industries

44 citations · 114 across the 10 of their papers we have counts for

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8 papers · 1 filter

quant-ph2026

Gate-Level Quantum Simulation of Nonunitary Linear Dynamics with Hybrid Oscillator-Qubit Architecture

Elin Ranjan Das, Muqing Zheng, Rishab Dutta +3

We translate the one-mode unitary-dilation framework for nonunitary linear dynamics into a gate-level hybrid oscillator--qubit architecture. An ancillary oscillator encodes the ker…

quant-ph2025★ 3 cited

Qumode-Based Variational Quantum Eigensolver for Molecular Excited States

Rishab Dutta, Cameron Cianci, Alexander V. Soudackov +5

We introduce the Qumode Subspace Variational Quantum Eigensolver (QSS-VQE), a hybrid quantum-classical algorithm for computing molecular excited states using the Fock basis of boso…

quant-ph2025★ 15 cited

A Perspective on Quantum Computing Applications in Quantum Chemistry using 25--100 Logical Qubits

Yuri Alexeev, Victor S. Batista, Nicholas Bauman +27

The intersection of quantum computing and quantum chemistry represents a promising frontier for achieving quantum utility in domains of both scientific and societal relevance. Owin…

quant-ph2025

Solving Constrained Optimization Problems Using Hybrid Qubit-Qumode Quantum Devices

Rishab Dutta, Brandon Allen, Chuzhi Xu +8

Variational Quantum Algorithms (VQAs) provide a promising framework for tackling complex optimization problems on near-term quantum hardware. Here, we demonstrate that hybrid qubit…

quant-ph2024★ 6 cited

Characterizing conical intersections of nucleobases on quantum computers

Yuchen Wang, Cameron Cianci, Irma Avdic +7

Hybrid quantum-classical computing algorithms offer significant potential for accelerating the calculation of the electronic structure of strongly correlated molecules. In this wor…

quant-ph2024★ 44 cited

Quantum Machine Learning in Drug Discovery: Applications in Academia and Pharmaceutical Industries

Anthony M. Smaldone, Yu Shee, Gregory W. Kyro +8

The nexus of quantum computing and machine learning - quantum machine learning - offers the potential for significant advancements in chemistry. This review specifically explores t…

quant-ph2024★ 3 cited

Simulating electronic structure on bosonic quantum computers

Rishab Dutta, Nam P. Vu, Chuzhi Xu +7

Quantum harmonic oscillators, or qumodes, provide a promising and versatile framework for quantum computing. Unlike qubits, which are limited to two discrete levels, qumodes have a…

quant-ph2024★ 35 cited

Simulating Chemistry on Bosonic Quantum Devices

Rishab Dutta, Delmar G. A. Cabral, Ningyi Lyu +23

Bosonic quantum devices offer a novel approach to realize quantum computations, where the quantum two-level system (qubit) is replaced with the quantum (an)harmonic oscillator (qum…