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...multiple molecular descriptors into a single score to provide a measure of drug-likeness. ...cular properties that are known to influence a molecule's suitability as a drug candidate, including: ...

{{Short description|Parameter used in drug design}} ...on decision-making in medicinal chemistry | journal = Nature Reviews. Drug Discovery | volume = 6 | issue = 11 | pages = 881–90 | date = November 2007 | pmid = ...

...factor, <math> x </math>, can act at multiple sites. For example, a given drug might act on multiple protein sites. The overall response is the sum of the These results show that the action of an external factor, such as a drug, has two components: ...

...vauthors = Gawehn E, Hiss JA, Schneider G | title = Deep Learning in Drug Discovery | journal = Molecular Informatics | volume = 35 | issue = 1 | pages = 3–14 ...

...ollet, J. P.; Lievre, M.; Girard, P. An effect model for the assessment of drug benefit: example of antiarrhythmic drugs in postmyocardial infarction patie ...e and predict health outcomes for a treatment available on the market or a drug candidate at any stage in the R&D process (from the target identification p ...

{{Short description|Route of drug administration}} ...sides using carriers, other factors such as [[pH]], [[lipophilicity]], and drug molecule size govern the effectiveness of topical formulation.<ref name=":0 ...

...Sarah A.|last2=Sommer|first2=André J.|title=Variable Path-Length Cells for Discovery-Based Investigation of the Beer–Lambert Law|journal=Journal of Chemical Edu ...he fields of [[medicine]], [[biotechnology]], [[pharmacology]], and [[drug discovery]]. It is particularly useful in the [[protein purification]] stage of biote ...

...arks have been established to describe the effects of a particular dose of drug in a particular species, such as NOEL(no-observed-effect-level), [[NOAEL]]( Threshold dose is a dose of drug barely adequate to produce a biological effect in an animal. In dose-respon ...

...n Medicines Agency]] (EMA) and the [[Food and Drug Administration|Food and drug Administration]] (FDA) as a medicine. The medicine is called Mirabegron and ...show/NCT03492281|title=A Study to Examine the Safety and Efficacy of a New Drug in Patients With Symptoms of Overactive Bladder (OAB) - Full Text View - Cl ...

{{Short description|Technologies for targeted drug delivery}} ...ir potential application for effective drug delivery.<ref>Nanoparticles as drug delivery systems,Pharmacological Reports, Volume 64, Issue 5,2012,Pages 102 ...

...nornicotine on nAChRs subtypes: relevance to nicotine dependence and drug discovery |journal=[[Journal of Neurochemistry]] |volume=101 |issue=1 |pages=160–7 |d ...

== Discovery == ...-galactosidase|β-galactosidase]] gene to alleviate gastrointestinal cancer drug toxicity by observing structures and inhibition of the [[Beta-glucuronidase ...

* Healthcare: Treatment planning and drug discovery. ...

...imental Design, and Computerized Simulation of Synergism and Antagonism in Drug Combination Studies |url=https://pharmrev.aspetjournals.org/content/58/3/62 ...nstant ratio or at non-constant ratios. The CI equations for three or more drug combinations have also been derived<ref name=":5" /> and can be subjected t ...

...3=Lise |title=A Probabilistic Approach for CollectiveSimilarity-based Drug-Drug Interaction Prediction |journal=Bioinformatics |date=2016 |volume=32 |issue ...ntity resolution in relational data |journal=ACM Transactions on Knowledge Discovery from Data |date=2007|volume=1 |page=5 |doi=10.1145/1217299.1217304 |hdl=190 ...

...be defined by the expansion rate <math>k_{\text{d}}</math>, introducing a discovery timescale <math>\tau_{\text{d}} \approx 1/k_{\text{d}}</math>. <ref name=": ...hese two distinct timescales <math>\tau_{\text{d}}</math>, for the initial discovery of an object, and <math>\tau_{\text{p}}</math>, for making copies of existi ...

...als of quantum computing. This is applicable to chemical simulations, drug discovery, energy production, [[climate model]]ing and fertilizer production (e.g. [[ ...

...ology, nutrition, biochemistry, and system dynamics. It applies whenever a drug or nutrient is infused or ingested at a relatively constant rate and when a ...y: A Topical Approach. Cambridge University Press. 1991.</ref> If the same drug is administered as a [[bolus (medicine)]] with a single injection, peak con ...

...itor-last5=Folkers|editor-first5=Gerd|title=Thermodynamics and Kinetics of Drug Binding|date=17 August 2015|publisher=John Wiley & Sons |isbn=9783527335824 ...er=Jones & Bartlett Publishers|isbn=9781449674267}}</ref>{{rp|196}} If the drug is delivered through a [[mucous membrane]] in the mouth, the residence time ...

...of much research because its inhibition by small molecules has led to the discovery of antineoplastic drugs. The folate-binding loop has been shown to change c ...ski A, Warren MS, Benkovic SJ, Wilson IA | title = Towards structure-based drug design: crystal structure of a multisubstrate adduct complex of glycinamide ...