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python function » protein function (Expand Search)
using function » using functional (Expand Search), sine function (Expand Search), waning function (Expand Search)
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ADT: A Generalized Algorithm and Program for Beyond Born–Oppenheimer Equations of “<i>N</i>” Dimensional Sub-Hilbert Space
Published 2020“…The “ADT” program can be efficiently used to (a) formulate analytic functional forms of differential equations for ADT angles and diabatic potential energy matrix and (b) solve the set of coupled differential equations numerically to evaluate ADT angles, residue due to singularity(ies), ADT matrices, and finally, diabatic potential energy surfaces (PESs). …”
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Performance of the smooth-index algorithm for matrices with different densities.
Published 2024“…<p><b>A</b> Example matrices for N = 50 neurons, given a density of 50% in the lower triangle<b>. B</b> Performance of the algorithm as a function of the number of neurons. …”
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Road density and connected vehicle road sections.
Published 2025“…Then, the upper-level model is solved using improved whale optimization, and the lower-level model is solved using improved Frank-Wolfe algorithm. …”
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Average input sensitivities for ANN model trained with only biophysical features.
Published 2022Subjects: -
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Discovery of Protein Modifications Using Differential Tandem Mass Spectrometry Proteomics
Published 2021“…Termed SAMPEI for spectral alignment-based modified peptide identification, this open-source algorithm is designed for the discovery of functional protein and peptide signaling modifications, without prior knowledge of their identities. …”
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Discovery of Protein Modifications Using Differential Tandem Mass Spectrometry Proteomics
Published 2021“…Termed SAMPEI for spectral alignment-based modified peptide identification, this open-source algorithm is designed for the discovery of functional protein and peptide signaling modifications, without prior knowledge of their identities. …”
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Constructing Accurate Potential Energy Surfaces with Limited High-Level Data Using Atom-Centered Potentials and Density Functional Theory
Published 2025“…These data are then used to fit atom-centered potentials (ACPs) that improve the accuracy of the PES predicted by a density-functional theory method. …”
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