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GS-DTA: integrating graph and sequence models for predicting drug-target binding affinity
Published 2025-02-01“…Abstract Background Drug-target binding affinity (DTA) prediction is vital in drug discovery and repositioning, more and more researchers are beginning to focus on this. …”
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Electroadhesion between a flat touchscreen and the human finger with randomly self-affine fractal surface
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Fuzzy Adaptive Dynamic Surface Control with Constant Gain for Non-Affine Pure-Feedback Systems
Published 2025-06-01“…This paper considers tracking control of non-affine pure-feedback systems with uncertain disturbances. …”
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Evolving superpixel-level affinity based on contrastive learning and good neighbors for hyperspectral image clustering
Published 2025-08-01“…Recently, graph clustering has been applied to hyperspectral image (HSI) clustering and proves to be effective on capturing the complex affinity among hyperspectral samples to a certain extent. …”
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Evidence of variable human Fcγ receptor-Fc affinities across differentially-complexed IgG
Published 2023-12-01“…Antibody-mediated effector functions are widely considered to unfold according to an associative model of IgG-Fcγ receptor (FcγR) interactions. …”
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Machine learning models for predicting interaction affinity energy between human serum proteins and hemodialysis membrane materials
Published 2025-01-01“…Various membrane materials with distinct characteristics, chemistry, and orientation are considered in conjunction with different proteins. A comparative analysis of linear regression, K-nearest neighbors regression, decision tree regression, random forest regression, XGBoost regression, lasso regression, and support vector regression is conducted to predict affinity energy. …”
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Flavone and Flavonol derivatives as adenosine A1/A2A receptor ligands: Structure-affinity insights
Published 2025-07-01“…Remarkably, it was observed that methylation on the C3 position of ring C increased A1 AR affinity and selectivity. Although only four compounds showed A2A AR affinity, it was seen that replacing the phenyl ring B with a furan ring resulted in compound 39 with the best A2A affinity of 0.25 μM. …”
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GramSeq-DTA: A Grammar-Based Drug–Target Affinity Prediction Approach Fusing Gene Expression Information
Published 2025-03-01“…Drug–target affinity (DTA) prediction is a critical aspect of drug discovery. …”
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Quantifying antibody binding: techniques and therapeutic implications
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Comprehensive inventory of páramo birds and their habitat affinities in a conservation hotspot, the Macizo del Cajas Biosphere Reserve, southern Ecuador
Published 2023-12-01“…We also provide notes on habitat affinity and important new, rare, restricted range, and threatened birds. …”
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Zero-Sum Game-Based Tracking Control for Fully-Coupled Nonaffine AUV With Unknown Affine Disturbance Using Critic Network
Published 2025-01-01“…In this paper, the unknown affine disturbance is considered and a two-player zero-sum game (TPZSG) is employed to design tracking control scheme for fully-coupled nonaffine AUV (FCNAUV). …”
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In Silico Profiling of Binding Affinities of Hybrid Molecules of Oseltamivir carboxamides cross-linked with Hydroxamic acid as possible Anti-influenza agents
Published 2025-05-01“…These hybrids have recorded slightly higher PLP fitness, binding affinities represented as docking scores (59.14-72.23 Kcal/mol) based on the lowest docking scores on the target enzyme compared to Oseltamivir acid (56.24 Kcal/mol). …”
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Low nanomolar affinity to major grass pollen allergen Phl p 5 as achieved in an unmutated human antibody-lineage ancestor
Published 2025-07-01“…This antibody, although subjected only to a low level of hypermutation resulting in six amino acid substitution across the heavy and light chain variable domains, has achieved sub-nM affinity for the allergen, suggesting that antibodies specific for this major group of allergens can be of high affinity even at the naïve, unmutated stage. …”
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Can Brand Affinity Outperform Political Parties' Rejection When Nominating Celebrity Politicians in a Post-Rebellion Multi-Party Context?
Published 2023-05-01“…This study contributes to the moderating role of brand affinity towards celebrity politicians. It considers celebrities' cognitive perceived benefits and voting intention relationship in a multi-party parliamentarian election. …”
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Computational Investigation of Montelukast and Its Structural Derivatives for Binding Affinity to Dopaminergic and Serotonergic Receptors: Insights from a Comprehensive Molecular S...
Published 2025-04-01“…MM/PBSA calculations quantified binding affinities, while ADME-Tox profiling predicted pharmacokinetic and toxicity risks. …”
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A quasi affine transformation evolution algorithm with evolution matrix selection operation for parameter estimation of proton exchange membrane fuel cells
Published 2025-01-01“…Abstract Electrochemical energy conversion technologies include proton exchange membrane fuel cells (PEMFCs) where proton interchange is an alternative to diesel distributed generation, and PEMFCs are considered as a promising backup power source and a tool to regulate power consumption. …”
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The Robust Control of a Nonsmooth or Switched Control-Affine Uncertain Nonlinear System Using an Auxiliary Robust Integral of the Sign of the Error (ARISE) Controller
Published 2025-04-01“…To deal with uncertainties in a dynamic system, many nonlinear control approaches have been considered. Unique challenges arise from uncertainties that are bounded by constants, which has led to the development of both continuous and discontinuous control methods. …”
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Neurological aspects of COVID-19. Management of patients with neurological diseases considering epidemiological situation
Published 2021-06-01“…Structure of virion SARS-CoV-2 determine possible affinity for a number of receptors expressed on the neuronal membrane; viral proteins or genetic material were found in the nervous tissue. …”
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