Bioinspired Quantum Oracle Circuits for Biomolecular Solutions of the Maximum Cut Problem.

Given an undirected, unweighted graph with n vertices and m edges, the maximum cut problem is to find a partition of the n vertices into disjoint subsets V1 and V2 such that the number of edges between them is as large as possible. Classically, it is an NP-complete problem, which has potential applications ranging from circuit layout design, statistical physics, computer vision, machine learning and network science to clustering. In this paper, we propose a biomolecular and a quantum algorithm to solve the maximum cut problem for any graph G. The quantum algorithm is inspired by the biomolecular algorithm and has a quadratic speedup over its classical counterparts, where the temporal and spatial complexities are reduced to, respectively, [Formula: see text] and [Formula: see text]. With respect to oracle-related quantum algorithms for NP-complete problems, we identify our algorithm as optimal. Furthermore, to justify the feasibility of the proposed algorithm, we successfully solve a typical maximum cut problem for a graph with three vertices and two edges by carrying out experiments on IBM's quantum simulator.

Biomolecular and quantum algorithms for the dominating set problem in arbitrary networks.

A dominating set of a graph [Formula: see text] is a subset U of its vertices V, such that any vertex of G is either in U, or has a neighbor in U. The dominating-set problem is to find a minimum dominating set in G. Dominating sets are of critical importance for various types of networks/graphs, and find therefore potential applications in many fields. Particularly, in the area of communication, dominating sets are prominently used in the efficient organization of large-scale wireless ad hoc and sensor networks. However, the dominating set problem is also a hard optimization problem and thus currently is not efficiently solvable on classical computers. Here, we propose a biomolecular and a quantum algorithm for this problem, where the quantum algorithm provides a quadratic speedup over any classical algorithm. We show that the dominating set problem can be solved in [Formula: see text] queries by our proposed quantum algorithm, where n is the number of vertices in G. We also demonstrate that our quantum algorithm is the best known procedure to date for this problem. We confirm the correctness of our algorithm by executing it on IBM Quantum's qasm simulator and the Brooklyn superconducting quantum device. And lastly, we show that molecular solutions obtained from solving the dominating set problem are represented in terms of a unit vector in a finite-dimensional Hilbert space.

Quantum Speedup for Inferring the Value of Each Bit of a Solution State in Unsorted Databases Using a Bio-Molecular Algorithm on IBM Quantum's Computers.

In this paper, we propose a bio-molecular algorithm with O( n 2) biological operations, O( 2n-1 ) DNA strands, O( n ) tubes and the longest DNA strand, O( n ), for inferring the value of a bit from the only output satisfying any given condition in an unsorted database with 2n items of n bits. We show that the value of each bit of the outcome is determined by executing our bio-molecular algorithm n times. Then, we show how to view a bio-molecular solution space with 2n-1 DNA strands as an eigenvector and how to find the corresponding unitary operator and eigenvalues for inferring the value of a bit in the output. We also show that using an extension of the quantum phase estimation and quantum counting algorithms computes its unitary operator and eigenvalues from bio-molecular solution space with 2n-1 DNA strands. Next, we demonstrate that the value of each bit of the output solution can be determined by executing the proposed extended quantum algorithms n times. To verify our theorem, we find the maximum-sized clique to a graph with two vertices and one edge and the solution b that satisfies b2 ≡ 1 (mod 15) and using IBM Quantum's backend.

Quantum Speedup for Protein Structure Prediction.

Protein structure prediction (PSP) predicts the native conformation for a given protein sequence. Classically, the problem has been shown to belong to the NP-complete complexity class. Its applications range from physics, through bioinformatics to medicine and quantum biology. It is possible however to speed it up with quantum computational methods, as we show in this paper. Here we develop a fast quantum algorithm for PSP in three-dimensional hydrophobic-hydrophilic model on body-centered cubic lattice with quadratic speedup over its classical counterparts. Given a protein sequence of n amino acids, our algorithm reduces the temporal and spatial complexities to, respectively, [Formula: see text] and O(n2 logn) . With respect to oracle-related quantum algorithms for the NP-complete problems, we identify our algorithm as optimal. To justify the feasibility of the proposed algorithm we successfully solve the problem on IBM quantum simulator involving 21 and 25 qubits. We confirm the experimentally obtained high probability of success in finding the desired conformation by calculating the theoretical probability estimations.

Quantum Speedup and Mathematical Solutions of Implementing Bio-Molecular Solutions for the Independent Set Problem on IBM Quantum Computers.

In this paper, we propose a bio-molecular algorithm with O( n2 + m ) biological operations, O( 2n ) DNA strands, O( n ) tubes and the longest DNA strand, O( n ), for solving the independent-set problem for any graph G with m edges and n vertices. Next, we show that a new kind of the straightforward Boolean circuit yielded from the bio-molecular solutions with m NAND gates, ( m +n × ( n + 1 )) AND gates and (( n × ( n + 1 ))/2) NOT gates can find the maximal independent-set(s) to the independent-set problem for any graph G with m edges and n vertices. We show that a new kind of the proposed quantum-molecular algorithm can find the maximal independent set(s) with the lower bound Ω ( 2n/2 ) queries and the upper bound O( 2n/2 ) queries. This work offers an obvious evidence for that to solve the independent-set problem in any graph G with m edges and n vertices, bio-molecular computers are able to generate a new kind of the straightforward Boolean circuit such that by means of implementing it quantum computers can give a quadratic speed-up. This work also offers one obvious evidence that quantum computers can significantly accelerate the speed and enhance the scalability of bio-molecular computers. Next, the element distinctness problem with input of n bits is to determine whether the given 2n real numbers are distinct or not. The quantum lower bound of solving the element distinctness problem is Ω ( 2n×(2/3) ) queries in the case of a quantum walk algorithm. We further show that the proposed quantum-molecular algorithm reduces the quantum lower bound to Ω (( 2n/2 )/( [Formula: see text]) queries. Furthermore, to justify the feasibility of the proposed quantum-molecular algorithm, we successfully solve a typical independent set problem for a graph G with two vertices and one edge by carrying out experiments on the backend ibmqx4 with five quantum bits and the backend simulator with 32 quantum bits on IBM's quantum computer.