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Showing below up to 50 results in range #51 to #100.

51. A cost-efficient numerical algorithm for the determinants of heptadiagonal matrices with Toeplitz structure: Label: en
52. A natural regularization of the adsorption integral equation with Langmuir-kernel: Label: en
53. Enumeration of constitutional isomers of methyl alkanes by means of alkyl biradicals: equivalence of odd and even isomer series of symmetrical methyl alkanes: Label: en
54. Quantum-mechanical four-body versus semi-classical three-body theories for double charge exchange in collisions of fast alpha particles with helium targets: Label: en
55. Optimized derivative fast Fourier transform with high resolution and low noise from encoded time signals: ovarian NMR spectroscopy: Label: en
56. Hybrid random batch idea and nonlinear conjugate gradient method for accelerating charged polymer dynamics simulation: Label: en
57. Collocation-based numerical simulation of fractional order Allen-Cahn equation: Label: en
58. An adaptive Steffensen-like families for solving nonlinear systems using frozen divided differences: Label: en
59. Topological indices and graph entropies for carbon nanotube Y-junctions: Label: en
60. An analysis of the torquoselectivity effect in a ring-opening reaction through Fermi-Dirac's entropy: revealing the origin of the stereoselectivity.: Label: en
61. Augmented ant colony algorithm for virtual drug discovery: Label: en
62. Unraveling the complexity of Exendin-4 folding through two distinct pathways: Label: en
63. High-order symmetric and energy-preserving collocation integrators for the second-order Hamiltonian system: Label: en
64. On the pseudoharmonic oscillator as a model for the electronic potential-energy function of a diatomic molecule: Label: en
65. An approach to Hammond's principle through Kullback-Leibler's entropy: Label: en
66. Geometric-algebraic approach to aqueous solutions of diprotic acids and its buffer mixtures: Label: en
67. Theoretical model for the prediction of lattice energy of diatomic metal halides: Label: en
68. On the variable inverse sum deg index: theory and applications: Label: en
69. Applications of the inverse degree index to molecular structures: Label: en
70. A conjecture on antisymmetrized geminal power wavefunctions: Label: en
71. Analysis of optimal iterative methods from a dynamical point of view by studying their stability properties: Label: en
72. Hopf bifurcation and periodic solutions in a coupled Brusselator model of chemical reactions: Label: en
73. The kinetics of three coupled irreversible elementary reactions: two parallel mixed second order reactions followed by a first order reaction: Label: en
74. Computation of resistance distance with Kirchhoff index of body centered cubic structure: Label: en
75. Generalized transmission neighbor indices: graph connectivity analysis and its chemical relevance: Label: en
76. Laws of physical chemistry: a potential tool for generating some series and to evaluate their sum: Label: en
77. Numerical simulation of the time fractional Gray-Scott model on 2D space domains using radial basis functions: Label: en
78. Hess' law requires modified mathematical rules for information entropy of interdependent chemical reactions: Label: en
79. Topological entropies of single walled carbon nanotubes: Label: en
80. A modified cusp condition for the single density equations of DFT and orbital-free DFT for atoms: Label: en
81. Accurate and efficient flux-corrected finite volume approximation for the fragmentation problem: Label: en
82. Exact solutions of the Schrödinger equation with a complex periodic potential: Label: en
83. Applicability of noninteger Bessel type orbital basis sets: numerical and analytical approaches: Label: en
84. A possible way to quantify the \textit{philicity} using molecular quantum similarity and chemical reactivity indices: Label: en
85. Covalent organic frameworks: topological characterizations, spectral patterns and graph entropies: Label: en
86. Some new results on energy of graphs with self loops: Label: en
87. Various mechanisms for double capture from helium targets by alpha particles: Label: en
88. Integral feedback in synthetic biology: negative-equilibrium catastrophe: Label: en
89. Interpretation of covolume in an extension of the Redlich-Kwong equation of state for real gases: Label: en
90. Derivative shape estimations with resolved overlapped peaks and reduced noise for time signals encoded by NMR spectroscopy with and without water suppression: Label: en
91. Application of floating spherical Gaussian orbital approach in redefining the atomic periodic descriptor: Label: en
92. A study of fermionic Cooper pairs: Label: en
93. Solution of quantum chemical problems by a very effective and relatively inexpensive two-step, fourteenth-order, phase-fitting procedure: Label: en
94. Extremely broken generalized \(\mathcal{PT}\) symmetry: Label: en
95. An optimal computational method for a general class of nonlinear boundary value problems: Label: en
96. Theoretical understanding of mechanochemical (ball-milling) synthesis of thioethers: a CDFT approach: Label: en
97. Global convergence domains for an efficient fifth order iterative scheme: Label: en
98. A high-order compact finite difference scheme and its analysis for the time-fractional diffusion equation: Label: en
99. Third (fourth) order accurate two-step super-stable cubic spline polynomial approximation for the second order non-linear initial-value problems: Label: en
100. A network-based parametrization of positive steady states of power-law kinetic systems: Label: en