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  1. 2321
    “…CADD methods such as docking, molecular dynamic, quantum mechanics/molecular mechanics, pharmacophore, virtual screening, and quantitative structure–activity relationship have been applied to the design and optimization of small molecule kinase inhibitors. …”
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    An Updated Review on Developing Small Molecule Kinase Inhibitors Using Computer-Aided Drug Design Approaches
  2. 2322
    por Saha, Pinaki, Nguyen, Minh Tho
    Publicado 2023
    “…Traditionally, structure elucidation is achieved using quantum mechanics (QM) based calculations that are usually tedious and time consuming for large nanoclusters. …”
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    Electron density mapping of boron clusters via convolutional neural networks to augment structure prediction algorithms
  3. 2323
    por Li, Jian, Che, Fanting, Wang, Zhuo, Fu, Anqi
    Publicado 2023
    “…Quantum private comparison (QPC) allows at least two users to compare the equality of their secret information, for which the security is based on the properties of quantum mechanics. To improve the use of quantum resources and the efficiency of private comparison, a new QPC protocol based on GHZ-like states is proposed. …”
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    Efficient Quantum Private Comparison without Sharing a Key
  4. 2324
    “…We used a combined sequence analysis and quantum mechanics approach to calculate accurate energies of the most frequent tRNA tertiary base pairing interactions. …”
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    Accurate energies of hydrogen bonded nucleic acid base pairs and triplets in tRNA tertiary interactions
  5. 2325
    por Putz, Mihai V.
    Publicado 2010
    “…Within the path integral Feynman formulation of quantum mechanics, the fundamental Heisenberg Uncertainty Relationship (HUR) is analyzed in terms of the quantum fluctuation influence on coordinate and momentum estimations. …”
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    On Heisenberg Uncertainty Relationship, Its Extension, and the Quantum Issue of Wave-Particle Duality
  6. 2326
    “…A quantum learning machine for binary classification of qubit states that does not require quantum memory is introduced and shown to perform with the minimum error rate allowed by quantum mechanics for any size of the training set. This result is shown to be robust under (an arbitrary amount of) noise and under (statistical) variations in the composition of the training set, provided it is large enough. …”
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    Quantum learning without quantum memory
  7. 2327
    por Dick, Rainer
    Publicado 2012
    “…We report on two extensions of the traditional analysis of low-dimensional structures in terms of low-dimensional quantum mechanics. On one hand, we discuss the impact of thermodynamics in one or two dimensions on the behavior of fermions in low-dimensional systems. …”
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    Inter-dimensional effects in nano-structures
  8. 2328
    “…Quantum mechanics predicts that certain stationary potentials can sustain bound states with an energy buried in the continuous spectrum of scattered states, the so-called bound states in the continuum (BIC). …”
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    Floquet bound states in the continuum
  9. 2329
    “…The generalized nonlinear Klien-Gordon equation plays an important role in quantum mechanics. In this paper, a new three-time level implicit approach based on cubic trigonometric B-spline is presented for the approximate solution of this equation with Dirichlet boundary conditions. …”
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    A New Trigonometric Spline Approach to Numerical Solution of Generalized Nonlinear Klien-Gordon Equation
  10. 2330
    “…Compared to classical solutions, our proposed approach can ensure the unconditional security and the perfect privacy protection based on the physical principle of quantum mechanics.…”
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    Secure Multiparty Quantum Computation for Summation and Multiplication
  11. 2331
    por Wang, Rui-Feng
    Publicado 2016
    “…One interpretation asserts that the A–B effect demonstrates that the vector potential is a physical reality that can result in the phase shift of a moving charge in quantum mechanics. The other interpretation asserts that the phase shift of the moving charge results from the interaction energy between the electromagnetic field of the moving charge and external electromagnetic fields. …”
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    An experimental proposal to test the physical effect of the vector potential
  12. 2332
    “…Uncertainty relation lies at the heart of quantum mechanics, characterizing the incompatibility of non-commuting observables in the preparation of quantum states. …”
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    A Stronger Multi-observable Uncertainty Relation
  13. 2333
    por HAYASHI, Masahito
    Publicado 2017
    “…Although the physical media used to transmit information ultimately obey quantum mechanics, we need to choose the type of coding depending on the kind of information device, classical or quantum, that is being used. …”
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    Finite-block-length analysis in classical and quantum information theory
  14. 2334
    por Vaccaro, Joan A.
    Publicado 2018
    “…This article is part of a discussion meeting issue ‘Foundations of quantum mechanics and their impact on contemporary society’.…”
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    The quantum theory of time, the block universe, and human experience
  15. 2335
    por Aerts, Diederik
    Publicado 2017
    “…To this end, we apply the creation-discovery view elaborated for quantum mechanics to relativity theory and in such a way that time and space become creations instead of discoveries and an underlying non temporal and non spatial reality comes into existence. …”
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    Relativity Theory Refounded
  16. 2336
    por Chajda, Ivan, Länger, Helmut
    Publicado 2018
    “…These form a counterpart to MV-algebras which are used in quantum structures as they form an algebraic semantic of many-valued logics as well as of the logic of quantum mechanics. We describe ideals and congruence kernels of these semirings with involution. …”
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    Ideals and their complements in commutative semirings
  17. 2337
    “…Motivated by the concepts of quantum mechanics and particle swarm optimization (PSO), quantum-behaved particle swarm optimization (QPSO) was developed to achieve better global search ability. …”
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    Fractional-order quantum particle swarm optimization
  18. 2338
    “…[Image: see text] Using molecular simulation techniques, we investigate the storage capabilities of H(2) gas by the clathrate of hydroquinone (HQ). Quantum mechanics calculations have been used to assess structure and interactions at the atomic scale and molecular dynamics to model the HQ clathrate at successive equilibriums during the processes of capture and release of H(2), as well as the diffusion of H(2) inside the clathrate structure. …”
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    Simulation of Capture and Release Processes of Hydrogen by β-Hydroquinone Clathrate
  19. 2339
    por Busemeyer, J. R., Wang, Z.
    Publicado 2019
    “…This article is part of the theme issue ‘Contextuality and probability in quantum mechanics and beyond’.…”
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    Hilbert space multidimensional modelling of continuous measurements
  20. 2340
    por Wilce, Alexander
    Publicado 2018
    “…This paper fails to derive quantum mechanics from a few simple postulates. However, it gets very close, and does so without much exertion. …”
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    A Royal Road to Quantum Theory (or Thereabouts)
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