Results 31 to 40 of about 5,401,847 (247)
Nature Communications, 2018 Characterization of nanoparticles is a complex and important problem for the vast number of applications that require them. Here, the authors present a method to uncover the two-dimensional distribution of length and diameter of anisotropic nanoparticles
Simon E. Wawra +5 more
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Pharmaceuticals, 2022 A range of drugs used in cancer treatment comes from natural sources. However, chemotherapy has been facing a major challenge related to multidrug resistance (MDR), a mechanism that results in a decrease in the intracellular concentration of ...
Elisa Frederico Seneme +5 more
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Prodrug Approach as a Strategy to Enhance Drug Permeability
PharmaceuticalsAbsorption and permeability are critical physicochemical parameters that must be balanced to achieve optimal drug uptake. These key factors are closely linked to the maximum absorbable dose required to provide appropriate plasma levels of drugs.
Mateus Mello de Souza +5 more
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Journal of Pure and Applied Microbiology, 2020 The most important products obtained for human needs are enzymes, through microbial sources. Hydrolytic enzymes occupied major industrial share such as esterases, lipases, amylases and proteases.
P. Joyruth, Lali Growther
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APL Materials, 2021 100 years have passed since the initiate of ferroelectrics, molecular ferroelectrics with homochirality. Although inorganic ceramics have gained widespread utilization, especially in electronic, optical, and energy harvesting devices, the development of ...
Xin Mu +6 more
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Molecular Generation and Optimization of Molecular Properties Using a Transformer Model
Big Data Mining and AnalyticsGenerating novel molecules to satisfy specific properties is a challenging task in modern drug discovery, which requires the optimization of a specific objective based on satisfying chemical rules.
Zhongyin Xu, Xiujuan Lei, Mei Ma, Yi Pan
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Scoring Methods in Lead Optimization of Molecular Glues [PDF]
Efficiency metrics are a simple and effective medicinal chemistry tool to track small molecule progress toward a preferred profile in lead optimization. Targeted protein degradation can be mediated by small molecules that act as a molecular glue between ...
Benjamin, Shields +7 more
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A Molecular Computing Approach to Solving Optimization Problems via Programmable Microdroplet Arrays [PDF]
, 2019 The search for novel forms of computing that show advantages as alternatives to the dominant von-Neuman model-based computing is important as it will enable different classes of problems to be solved.
Yudong, Cao +14 more
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Finding the most potent compounds using active learning on molecular pairs
Beilstein Journal of Organic ChemistryActive learning allows algorithms to steer iterative experimentation to accelerate and de-risk molecular optimizations, but actively trained models might still exhibit poor performance during early project stages where the training data is limited and ...
Zachary Fralish, Daniel Reker
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Leveraging Adaptive Evolutionary Optimization for Drug Molecular Design Involving Many Properties
Big Data Mining and AnalyticsWith the fast development of artificial intelligence, a lot of translation methods and search methods have been proposed to address molecular optimization problems in drug design, which enables this field to achieve remarkable progress. However, existing
Xin Xia +5 more
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