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   Articles with "interaction potential" as a keyword



Evaluation of Drug-Drug Interaction Potential of Enarodustat (JTZ-951) Using a Cytochrome P450 Probe Cocktail.

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recommendations! Published in 2023 at "Clinical pharmacology in drug development"

DOI: 10.1002/cpdd.1263

Abstract: The drug interaction potential of enarodustat (doses: 25, 50 mg) on the activity of cytochrome P450 (CYP) 1A2, 2C9, 2C19, 2D6, and 3A4 was evaluated after once-daily administration for 15 days in a phase 1 multiple-ascending-dose… read more here.

Keywords: interaction potential; day; enarodustat; drug interaction ... See more keywords
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Clinical Assessment of the Drug Interaction Potential of the Psychotropic Natural Product Kratom

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recommendations! Published in 2023 at "Clinical pharmacology and therapeutics"

DOI: 10.1002/cpt.2891

Abstract: Oral formulations prepared from the leaves of the kratom (Mitragyna speciosa) plant are increasingly used for their opioid‐like effects to self‐manage opioid withdrawal and pain. Calls to US poison centers involving kratom exposures increased >50‐fold… read more here.

Keywords: interaction potential; kratom; drug interaction; natural product ... See more keywords

Metabolite profiling and evaluation of CYP450 interaction potential of 'Trimada'- An Ayurvedic formulation.

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recommendations! Published in 2020 at "Journal of ethnopharmacology"

DOI: 10.1016/j.jep.2020.113457

Abstract: ETHNOPHARMACOLOGICAL RELEVANCE Trimada is well-known polyherbal Ayurvedic formulation used in Indian Traditional medicine since ancient times. It consisted of three inebriant herbs including "Chitraka" (Plumbago zeylanica Linn. Family- Plumabaginaceae), "Musta" (Cyperus rotundus Linn. Family- Cyperaceae)… read more here.

Keywords: interaction potential; individual herbs; trimada; formulation ... See more keywords

On the analytic smoothing effect for the Hartree equation with a short range interaction potential

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recommendations! Published in 2017 at "Journal of Mathematical Analysis and Applications"

DOI: 10.1016/j.jmaa.2017.05.067

Abstract: Abstract We consider the Cauchy problem for the Hartree equation in space dimension d ≥ 2 . We assume that the interaction potential V ( x ) is short range. More precisely, we consider the… read more here.

Keywords: interaction potential; short range; hartree equation; space ... See more keywords

Unveiling the Interaction Potential Surface between Drug-Entrapped Polymeric Micelles Clarifying the High Drug Nanocarrier Efficiency.

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recommendations! Published in 2021 at "Nano letters"

DOI: 10.1021/acs.nanolett.0c03978

Abstract: Polymeric micelles are invaluable media as drug nanocarriers. Although knowledge of an interaction between the micelles is a key to understanding the mechanisms and developing the superior functions, the interaction potential surface between drug-incorporated polymeric… read more here.

Keywords: potential surface; interaction potential; surface drug; drug ... See more keywords

Global ranking of the sensitivity of interaction potential contributions within classical molecular dynamics force fields

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recommendations! Published in 2024 at "npj Computational Materials"

DOI: 10.1038/s41524-024-01272-z

Abstract: Uncertainty quantification (UQ) is rapidly becoming a sine qua non for all forms of computational science out of which actionable outcomes are anticipated. Much of the microscopic world of atoms and molecules has remained immune… read more here.

Keywords: force fields; classical molecular; force; molecular dynamics ... See more keywords
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Geometric description of self-interaction potential in symmetric protein complexes

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recommendations! Published in 2019 at "Scientific Data"

DOI: 10.1038/s41597-019-0058-x

Abstract: Proteins can self-associate with copies of themselves to form symmetric complexes called homomers. Homomers are widespread in all kingdoms of life and allow for unique geometric and functional properties, as reflected in viral capsids or… read more here.

Keywords: protein; potential symmetric; description self; interaction potential ... See more keywords

Role of range of interaction potential on structure and dynamics of a one-component system of particles interacting via Mie potential

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recommendations! Published in 2024 at "AIP Advances"

DOI: 10.1063/5.0199631

Abstract: The thermodynamic and transport properties of a fluid depend significantly on the particle interactions at the molecular level. The range of these interparticle interactions thus plays a crucial role in determining its phase behavior. In… read more here.

Keywords: range interaction; via mie; interaction potential; interaction ... See more keywords

Strong effect of the interaction potential cut-off on the crystallinity of films grown by simulations

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recommendations! Published in 2017 at "Molecular Simulation"

DOI: 10.1080/08927022.2017.1319056

Abstract: Abstract The paper deals with the methodology of film growth simulations using classical molecular dynamics and an empirical interaction potential. We focus on the effect of the cut-off distance (rC) of the short-range part of… read more here.

Keywords: effect; crystallinity; interaction potential; cut ... See more keywords

Assessment of Herb-Drug Interaction Potential of Five Common Species of Licorice and Their Phytochemical Constituents.

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recommendations! Published in 2022 at "Journal of dietary supplements"

DOI: 10.1080/19390211.2022.2050875

Abstract: Abstract The dried roots and rhizomes of Glycyrrhiza species (G. glabra, G. uralensis and G. inflata), commonly known as licorice, have long been used in traditional medicine. In addition, two other species, G. echinata and… read more here.

Keywords: interaction potential; activity; herb drug; drug interaction ... See more keywords

Analytical interaction potential for Lennard-Jones rods.

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recommendations! Published in 2024 at "Physical review. E"

DOI: 10.1103/physreve.111.015403

Abstract: An analytical form has been derived using Ostrogradsky's integration method for the interaction between two thin rods of finite lengths in arbitrary relative configurations in a three-dimensional space, each treated as a line of point… read more here.

Keywords: lennard jones; potential lennard; analytical interaction; interaction potential ... See more keywords