Results 11 to 20 of about 24,681 (243)
ADME-AP: a database of ADME associated proteins [PDF]
Bioinformatics, 2002 Abstract Summary: Drug absorption, distribution, metabolism and excretion (ADME) often involve interaction of a drug with specific proteins. Knowledge about these ADME-associated proteins is important in facilitating the study of the molecular mechanism of disposition and individual response as well as therapeutic action of drugs.
Li Zhi Sun +4 more
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ADM worldvolume geometry [PDF]
Nuclear Physics B - Proceedings Supplements, 2000 4 pages, Latex. Uses espcrc2.sty To appear in the proceedings of the Third Conference on Constrained Dynamics and Quantum Gravity, September, 1999. To appear in Nuclear Physics B (Proceedings Supplement)
Capovilla, Riccardo +2 more
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ADME-Space: a new tool for medicinal chemists to explore ADME properties [PDF]
Scientific Reports, 2017 AbstractWe introduce a new chemical space for drugs and drug-like molecules, exclusively based on their in silico ADME behaviour. This ADME-Space is based on self-organizing map (SOM) applied to 26,000 molecules. Twenty accurate QSPR models, describing important ADME properties, were developed and, successively, used as new molecular descriptors not ...
Bocci, Giovanni +5 more
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, 2019 Abstrak— This article aims to fulfill administrative duties and educational supervision. Where this article is titled "Administration of special service". This article was created to fulfill the administration and supervision courses. This article is about how special service in the world of education.
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Docking Simulations and Virtual Screening to find Novel Ligands for T3S in Yersinia pseudotuberculosis YPIII, A drug target for type III secretion (T3S) in the Gram-negative pathogen Yersinia pseudotuberculosis [PDF]
Chemical Review and Letters, 2021 In the Gram-negative pathogen Yersinia pseudotuberculosis and Chlamydia, the aggregate use of molecular docking, molecular dynamic simulations, and ADMET was successfully used to develop salicylidene acyl hydrazides as type III secretion (T3S) inhibitors.
Emmanuel Edache +3 more
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ADMET and DMPK, 2020 The accurate prediction of solubility of drugs is still problematic. It was thought for a long time that shortfalls had been due the lack of high-quality solubility data from the chemical space of drugs.
Alex Avdeef
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Multi-lab intrinsic solubility measurement reproducibility in CheqSol and shake-flask methods
ADMET and DMPK, 2019 This commentary compares 233 CheqSol intrinsic solubility values (log S0) reported in the Wiki-pS0 database for 145 different druglike molecules to the 838 log S0 values determined mostly by the saturation shake-flask (SSF) method for 124 of the ...
Alex Avdeef
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ADMET and DMPK, 2020 The prediction of solubility of drugs usually calls on the use of several open-source/commercially-available computer programs in the various calculation steps.
Alex Avdeef
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Molecular Docking Studies and ADME Predictions on Synthesized Chalcone Compounds Targeting EGFR
Hittite Journal of Science and Engineering, 2023 In the present study, new chalcone derivatives (5a–5f) obtained from the condensation reaction of cuminaldehyde and acetophenone compounds containing different substituents were reported.
Özlem Gündoğdu
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Cell Reports Medicine, 2021 Summary: Fibrosing chronic graft-versus-host disease (cGVHD) is a debilitating complication of allogeneic stem cell transplantation (alloSCT). A driver of fibrosis is the kynurenine (Kyn) pathway, and Kyn metabolism patterns and cytokines may influence ...
Laura Orsatti +9 more
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