Articles with "drug molecules" as a keyword



Metal–Drug Coordination Nanoparticles and Hydrogels for Enhanced Delivery

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Published in 2024 at "Advanced Materials"

DOI: 10.1002/adma.202404053

Abstract: Drug delivery is a key component of nanomedicine, and conventional delivery relies on the adsorption or encapsulation of drug molecules to a nanomaterial. Many delivery vehicles contain metal ions, such as metal–organic frameworks, metal oxides,… read more here.

Keywords: delivery; drug molecules; drug; metal ... See more keywords

Mechanistic insights on nsSNPs on binding site of renin and cytochrome P450 proteins: A computational perceptual study for pharmacogenomics evaluation

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Published in 2021 at "Journal of Cellular Biochemistry"

DOI: 10.1002/jcb.30069

Abstract: Past several decades, therapeutic investigations lead to the discovery of numerous antihypertensive drugs. Although it has been proved for their potency, altered efficacy is common norms in several conditions due to genetic variations. Cytochrome P450… read more here.

Keywords: study; drug; drug molecules; cytochrome p450 ... See more keywords

A polychromatic turbidity microplate assay to distinguish discovery stage drug molecules with beneficial precipitation properties.

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Published in 2017 at "International journal of pharmaceutics"

DOI: 10.1016/j.ijpharm.2017.07.086

Abstract: A material sparing microplate screening assay was developed to evaluate and compare the precipitation of discovery stage drug molecules as a function of time, concentration and media composition. Polychromatic turbidity time course profiles were collected… read more here.

Keywords: precipitation; drug molecules; discovery stage; turbidity ... See more keywords

Highly Sensitive and Interference-Free Detection of Multiple Drug Molecules in Serum Using Dual-Modified SERS Substrates Combined with AI Algorithm Analysis.

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Published in 2025 at "Analytical chemistry"

DOI: 10.1021/acs.analchem.4c06724

Abstract: Surface-enhanced Raman spectroscopy (SERS) technology has shown broad potential in drug concentration detection, but its application in blood drug monitoring faces significant challenges. The primary difficulty lies in overcoming the interference caused by various biomolecules… read more here.

Keywords: detection; detection multiple; drug molecules; free detection ... See more keywords

Triazine-Based Hexacarboxylate Metal-Organic Framework Crystalline Materials: Synthesis, Structural Characterization, and Fluorescence Response toward NACs and Small Drug Molecules.

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Published in 2025 at "Inorganic chemistry"

DOI: 10.1021/acs.inorgchem.5c00221

Abstract: A new triazine-based polycarboxylate metal-organic framework with a three-dimensional microporous structure, (H3O)2·[Eu2(TDPAT)4/3(μ-H2O)]·7H2O·EtOH·5DMA (complex 1), was constructed by the reaction of the ligand 2,4,6-tris(3,5-dicarboxyaniline)-1,3,5-triazine (H6TDPAT) and EuCl3·6H2O under solvothermal conditions. It was characterized by infrared spectroscopy… read more here.

Keywords: organic framework; fluorescence; drug molecules; triazine based ... See more keywords

PrimaDORAC: A Free Web Interface for the Assignment of Partial Charges, Chemical Topology, and Bonded Parameters in Organic or Drug Molecules.

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Published in 2017 at "Journal of chemical information and modeling"

DOI: 10.1021/acs.jcim.7b00145

Abstract: We present PrimaDORAC, a simple and freely accessible web interface for generating the topology and the parameter files of organic or drug molecules to be used in molecular mechanics or molecular dynamics calculations. The interface… read more here.

Keywords: organic drug; web interface; topology; drug molecules ... See more keywords

Prediction of Membrane Permeation of Drug Molecules by Combining an Implicit Membrane Model with Machine Learning

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Published in 2019 at "Journal of chemical information and modeling"

DOI: 10.1021/acs.jcim.8b00648

Abstract: Lipid membrane permeation of drug molecules was investigated with Heterogeneous Dielectric Generalized Born (HDGB)-based models using solubility-diffusion theory and machine learning. Free energy profiles were obtained for neutral molecules by the standard HDGB and Dynamic… read more here.

Keywords: machine learning; permeation drug; drug molecules; membrane ... See more keywords
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Diffusion Behavior of Drug Molecules in Acrylic Pressure-Sensitive Adhesive

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Published in 2020 at "ACS Omega"

DOI: 10.1021/acsomega.0c00491

Abstract: Acrylic pressure-sensitive adhesive (PSA) is widely used in transdermal drug delivery systems, while the diffusion behavior of drug molecules in PSA is of great importance. In this paper, PSAs with different cross-link densities were prepared… read more here.

Keywords: diffusion behavior; diffusion; acrylic pressure; drug ... See more keywords

Late-Stage C(sp3)-H Methylation of Drug Molecules.

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Published in 2023 at "Journal of the American Chemical Society"

DOI: 10.1021/jacs.2c13396

Abstract: Methyl groups are well understood to play a critical role in pharmaceutical molecules, especially those bearing saturated heterocyclic cores. Accordingly, methods that install methyl groups onto complex molecules are highly coveted. Late-stage C-H functionalization is… read more here.

Keywords: methyl groups; drug molecules; stage sp3; late stage ... See more keywords

Abstract 827: Comparative study of calcein encapsulation into nanoparticles using three different micromixers as a model for small drug molecules

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Published in 2023 at "Cancer Research"

DOI: 10.1158/1538-7445.am2023-827

Abstract: Background: Liposomes are spherical vesicles made of a lipid bilayer and are effective nanocarriers for drug molecules such as chemotherapeutic agents. Micromixers are devices that allow consistent liposome production while more efficiently controlling their characteristics… read more here.

Keywords: ring micromixer; drug molecules; encapsulation; calcein ... See more keywords

Targets preliminary screening for the fresh natural drug molecule based on Cosine-correlation and similarity-comparison of local network

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Published in 2022 at "Journal of Translational Medicine"

DOI: 10.1186/s12967-022-03279-w

Abstract: Background Chinese herbal medicine is made up of hundreds of natural drug molecules and has played a major role in traditional Chinese medicine (TCM) for several thousand years. Therefore, it is of great significance to… read more here.

Keywords: drug; fresh natural; medicine; natural drug ... See more keywords