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 …
Biology and medicine in the landscape of quantum advantages
Quantum computing holds substantial potential for applications in biology and medicine,
spanning from the simulation of biomolecules to machine learning methods for subty** …
spanning from the simulation of biomolecules to machine learning methods for subty** …
Current structure predictors are not learning the physics of protein folding
Motivation. Predicting the native state of a protein has long been considered a gateway
problem for understanding protein folding. Recent advances in structural modeling driven by …
problem for understanding protein folding. Recent advances in structural modeling driven by …
[HTML][HTML] Quantum computing for chemical and biomolecular product design
Highlights•Quantum computing and its use for computer-aided product design is discussed
and perspectives for several types of problems are provided.•Hybrid QC methods are likely …
and perspectives for several types of problems are provided.•Hybrid QC methods are likely …
Orders of magnitude increased accuracy for quantum many-body problems on quantum computers via an exact transcorrelated method
Transcorrelated methods provide an efficient way of partially transferring the description of
electronic correlations from the ground-state wave function directly into the underlying …
electronic correlations from the ground-state wave function directly into the underlying …
Digitized counterdiabatic quantum optimization
We propose digitized-counterdiabatic quantum optimization (DCQO) to achieve polynomial
enhancement over adiabatic quantum optimization for the general Ising spin-glass model …
enhancement over adiabatic quantum optimization for the general Ising spin-glass model …
QFold: quantum walks and deep learning to solve protein folding
We develop quantum computational tools to predict the 3D structure of proteins, one of the
most important problems in current biochemical research. We explain how to combine …
most important problems in current biochemical research. We explain how to combine …
Folding lattice proteins with quantum annealing
Quantum annealing is a promising approach for obtaining good approximate solutions to
difficult optimization problems. Folding a protein sequence into its minimum-energy structure …
difficult optimization problems. Folding a protein sequence into its minimum-energy structure …
Quantum computing in bioinformatics: a systematic review map**
K Nałęcz-Charkiewicz, K Charkiewicz… - Briefings in …, 2024 - academic.oup.com
The field of quantum computing (QC) is expanding, with efforts being made to apply it to
areas previously covered by classical algorithms and methods. Bioinformatics is one such …
areas previously covered by classical algorithms and methods. Bioinformatics is one such …
Orders of magnitude reduction in the computational overhead for quantum many-body problems on quantum computers via an exact transcorrelated method
Transcorrelated methods provide an efficient way of partially transferring the description of
electronic correlations from the ground state wavefunction directly into the underlying …
electronic correlations from the ground state wavefunction directly into the underlying …