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algorithms bessel » algorithms based (Expand Search), algorithms less (Expand Search), algorithm based (Expand Search)
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bessel function » based function (Expand Search), kernel functions (Expand Search)
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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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Revisiting the “satisfaction of spatial restraints” approach of MODELLER for protein homology modeling
Published 2019“…This program implements the “modeling by satisfaction of spatial restraints” strategy and its core algorithm has not been altered significantly since the early 1990s. …”
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DataSheet2_Benefits and Challenges of Pre-clustered Network-Based Pathway Analysis.PDF
Published 2022“…<p>Functional analysis of gene sets derived from experiments is typically done by pathway annotation. …”
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DataSheet1_Benefits and Challenges of Pre-clustered Network-Based Pathway Analysis.CSV
Published 2022“…<p>Functional analysis of gene sets derived from experiments is typically done by pathway annotation. …”
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Modeling Molecularly Imprinted Nanoparticles with LNKD: A Resource Efficient Algorithm for Polymer Cross-Linking
Published 2025“…Here, we propose LNKD (Linking Nodes in KD-trees), a resource-efficient algorithm for predicting pairs of reactive atoms in pre-cross-linked 3D structures of monomers that applies not only to the modeling of MIPs, but also chemical cross-linking in other materials. …”
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Python code, input data, and outputs of Fourier analysis and Dynamic Time Warping from McGlasson et al.
Published 2024“…</p> <h4><strong>Python Function Files:</strong></h4> <p>radarfuncs.py: Holds three functions used for FFT and DTW analysis.…”
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ClaritySpectra: Raman spectra analysis tool
Published 2025“…</li></ul><h3>PEAK FITTING </h3><ul><li>Automated background subtraction using asymmetric least squares fitting</li><li>A new suggested background feature that lets you preview the background that you like best</li><li>Interactive background fitting lets you further tune the background to perfection</li><li>Four choice of peaks: Gaussian, Lorentzian, Pseudo-Voigt, and the new Asymmetric Voigt functions</li><li>Overlapping view of how well the peaks fit with quality metrics</li><li>No need to define regions, the algorithm is smart enough to what a peak looks like.…”
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