A QUBO-based hydration-site prediction workflow, executed on IBM Heron hardware up to 123 qubits, locates protein-pocket crystal waters with accuracy comparable to leading classical methods.
Optimization by Simulated Annealing: An Experimental Evaluation; Part II, Graph Coloring and Number Partitioning
1 Pith paper cite this work, alongside 844 external citations. Polarity classification is still indexing.
1
Pith paper citing it
844
external citations · OpenAlex
fields
quant-ph 1years
2025 1verdicts
CONDITIONAL 1representative citing papers
citing papers explorer
-
Practical protein-pocket hydration-site prediction for drug discovery on a quantum computer
A QUBO-based hydration-site prediction workflow, executed on IBM Heron hardware up to 123 qubits, locates protein-pocket crystal waters with accuracy comparable to leading classical methods.