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[HTML][HTML] The variational quantum eigensolver: a review of methods and best practices
The variational quantum eigensolver (or VQE), first developed by Peruzzo et al.(2014), has
received significant attention from the research community in recent years. It uses the …
received significant attention from the research community in recent years. It uses the …
Perspective on the current state-of-the-art of quantum computing for drug discovery applications
Computational chemistry is an essential tool in the pharmaceutical industry. Quantum
computing is a fast evolving technology that promises to completely shift the computational …
computing is a fast evolving technology that promises to completely shift the computational …
Ground-state preparation and energy estimation on early fault-tolerant quantum computers via quantum eigenvalue transformation of unitary matrices
Under suitable assumptions, some recently developed quantum algorithms can estimate the
ground-state energy and prepare the ground state of a quantum Hamiltonian with near …
ground-state energy and prepare the ground state of a quantum Hamiltonian with near …
Quantum-centric supercomputing for materials science: A perspective on challenges and future directions
Computational models are an essential tool for the design, characterization, and discovery
of novel materials. Computationally hard tasks in materials science stretch the limits of …
of novel materials. Computationally hard tasks in materials science stretch the limits of …
Quantum chemistry in the age of quantum computing
Practical challenges in simulating quantum systems on classical computers have been
widely recognized in the quantum physics and quantum chemistry communities over the …
widely recognized in the quantum physics and quantum chemistry communities over the …
Drug design on quantum computers
The promised industrial applications of quantum computers often rest on their anticipated
ability to perform accurate, efficient quantum chemical calculations. Computational drug …
ability to perform accurate, efficient quantum chemical calculations. Computational drug …
Heisenberg-limited ground-state energy estimation for early fault-tolerant quantum computers
Under suitable assumptions, the quantum-phase-estimation (QPE) algorithm is able to
achieve Heisenberg-limited precision scaling in estimating the ground-state energy …
achieve Heisenberg-limited precision scaling in estimating the ground-state energy …
Quantum computing enhanced computational catalysis
The quantum computation of electronic energies can break the curse of dimensionality that
plagues many-particle quantum mechanics. It is for this reason that a universal quantum …
plagues many-particle quantum mechanics. It is for this reason that a universal quantum …
The prospects of quantum computing in computational molecular biology
Quantum computers can in principle solve certain problems exponentially more quickly than
their classical counterparts. We have not yet reached the advent of useful quantum …
their classical counterparts. We have not yet reached the advent of useful quantum …
Quantum algorithm for ground state energy estimation using circuit depth with exponentially improved dependence on precision
A milestone in the field of quantum computing will be solving problems in quantum chemistry
and materials faster than state-of-the-art classical methods. The current understanding is …
and materials faster than state-of-the-art classical methods. The current understanding is …