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algorithm protein » algorithm within (Expand Search), algorithm pre (Expand Search)
algorithm python » algorithm within (Expand Search), algorithms within (Expand Search), algorithm both (Expand Search)
algorithm cep » algorithm cl (Expand Search), algorithm co (Expand Search), algorithm seu (Expand Search)
cep function » cell function (Expand Search), step function (Expand Search), t4p 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“…In order to overcome such shortcoming, we develop a generalized algorithm, “ADT” to generate the nonadiabatic equations through symbolic manipulation and to construct highly accurate diabatic surfaces for molecular processes involving excited electronic states. …”
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NRPStransformer, an Accurate Adenylation Domain Specificity Prediction Algorithm for Genome Mining of Nonribosomal Peptides
Published 2025“…Leveraging the sequences within the flavodoxin-like subdomain, we developed a substrate specificity prediction algorithm using a protein language model, achieving 92% overall prediction accuracy for 43 frequently observed amino acids, significantly improving the prediction reliability. …”
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Dynamical comparison between Drosha and Dicer reveals functional motion similarities and dissimilarities
Published 2019“…Since dynamics is essential for protein function, a comparison at their dynamics level is fundamental for a complete understanding of the overall relations between these proteins. …”
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Morpheus: A fragment-based algorithm to predict metamorphic behaviour in proteins across proteomes
Published 2025“…<p dir="ltr">Supplementary material for Morpheus: A fragment-based algorithm to predict metamorphic behaviour in proteins across proteomes.…”
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Development and Evaluation of GlycanDock: A Protein–Glycoligand Docking Refinement Algorithm in Rosetta
Published 2021“…These highly diverse chains are recognized by a variety of protein receptors, enabling glycans to regulate many biological functions. …”
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Development and Evaluation of GlycanDock: A Protein–Glycoligand Docking Refinement Algorithm in Rosetta
Published 2021“…These highly diverse chains are recognized by a variety of protein receptors, enabling glycans to regulate many biological functions. …”
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Development and Evaluation of GlycanDock: A Protein–Glycoligand Docking Refinement Algorithm in Rosetta
Published 2021“…These highly diverse chains are recognized by a variety of protein receptors, enabling glycans to regulate many biological functions. …”
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Development and Evaluation of GlycanDock: A Protein–Glycoligand Docking Refinement Algorithm in Rosetta
Published 2021“…These highly diverse chains are recognized by a variety of protein receptors, enabling glycans to regulate many biological functions. …”
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Development and Evaluation of GlycanDock: A Protein–Glycoligand Docking Refinement Algorithm in Rosetta
Published 2021“…These highly diverse chains are recognized by a variety of protein receptors, enabling glycans to regulate many biological functions. …”
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Results of the application of different clustering algorithms to average functional connectivity from healthy subjects.
Published 2023“…<p>A) Resulting cluster inertia from applying the k-means algorithm described in the methods to empirical averaged functional connectivity from healthy subjects, with different numbers of clusters. …”
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Flexible CDOCKER: Hybrid Searching Algorithm and Scoring Function with Side Chain Conformational Entropy
Published 2021“…The binding of small-molecule ligands to protein or nucleic acid targets is important to numerous biological processes. …”
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Flexible CDOCKER: Hybrid Searching Algorithm and Scoring Function with Side Chain Conformational Entropy
Published 2021“…The binding of small-molecule ligands to protein or nucleic acid targets is important to numerous biological processes. …”
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