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Virtual Screening Applications in the Search of Novel Antiepileptic Drug Candidates
(Springer, 2016)
Virtual screening (VS) encompasses a wide spectrum of computational approaches oriented to prioritize which compounds from chemical libraries or repositories will be subjected to experimental in vitro and in vivo testing. ...
In silico and in vitro: identifying new drugs
(Bentham Science Publishers Ltd, 2015)
In silico drug repositioning for chagas disease
(Bentham Science Publishers, 2020)
Chagas disease is an infectious tropical disease included within the group of neglected tropical diseases. Though historically endemic to Latin America, it has lately spread to high-income countries due to human migration. ...
The importance of bioactivation in computer-guided drug repositioning: Why the parent drug is not always enough
(Bentham Science Publishers, 2016-08)
Although bioactivation is a well-documented process and the role of active metabolites in the drug discovery field has long been recognized, drug metabolites are usually ignored in virtual screening campaigns oriented to ...
Tailored Multi-Target Agents: Applications and Design Considerations
(Bentham Science Publishers, 2016-03)
In contrast to the one target-one drug model, multi-target agents seem as a promising alternative to manage complex disorders and health conditions linked to drug resistance issues. In fact, many longstanding drugs are in ...
Modern Approaches for the Discovery of Anti-Infectious Drugs for the Treatment of Neglected Diseases
(Bentham Science Publishers, 2018-07)
Neglected diseases comprise a number of infectious diseases historically endemic to low-and middle-income countries, though recently they have spread to high-income countries due to human migrations. In the past, pharmaceutical ...
Screening of Novel Bioactive Peptides from Goat Casein: In Silico to In Vitro Validation
(2022-03-01)
Food-derived bioactive peptides are of great interest to science and industry due to evolving drivers of food product innovation, including health and wellness. This study aims to draw attention through a critical study ...
Síntesis y evaluación in silico e in vitro de derivados del ácido valproico como antineoplásicos
(2011-05-05)
Histone deacetylases are a group of enzymes that are characterized for catalyzing the separation of the acetyl group of the acetylated lysines on histones. This has an effect of compaction of genetic material involved in ...
In silico screening strategies for novel inhibitors of parasitic diseases
(Informa HealthcareLondon, 2011-05)
Introduction: Parasitic diseases are a major global problem causing long-term disability and death, with severe medical and psychological consequences around the world. Despite the prevalence of parasitic disease, the ...