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Perturbation theory/machine learning model of ChEMBL data for dopamine targets: docking, synthesis, and assay of new l-prolyl-l-leucyl-glycinamide peptidomimetics
(American Chemical Society, 2018-05-23)
[Abstract] Predicting drug–protein interactions (DPIs) for target proteins involved in dopamine pathways is a very important goal in medicinal chemistry. We can tackle this problem using Molecular Docking or Machine Learning ...
Mapping networks of anti-HIV drug cocktails vs. AIDS epidemiology in the US counties
(Elsevier, 2014-08-20)
[Abstract] The implementation of the highly active antiretroviral therapy (HAART) and the combination of anti-HIV drugs have resulted in longer survival and a better quality of life for the people infected with the virus. ...
Diagnostic and treatment delay, quality of life and satisfaction with care in colorectal cancer patients: a study protocol
(BioMed Central, 2013-07-11)
[Abstract]
Background. Due to recent improvements in colorectal cancer survival, patient-reported outcomes, including health-related quality of life and satisfaction with care, have become well-established endpoints to ...
Bio-AIMS collection of chemoinformatics web tools based on molecular graph information and artificial intelligence models
(Bentham, 2015-09-01)
[Abstract] The molecular information encoding into molecular descriptors is the first step into in silico Chemoinformatics methods in Drug Design. The Machine Learning methods are a complex solution to find prediction ...
Experimental and computational studies of fatty acid distribution networks
(Royal Society of Chemistry, 2015-08-06)
[Abstract] Unbalanced uptake of Omega 6/Omega 3 (ω-6/ω-3) ratios could increase chronic disease occurrences, such as inflammation, atherosclerosis, or tumor proliferation, and methylation methods for measuring the ruminal ...
Effect of diagnostic delay on survival in patients with colorectal cancer: a retrospective cohort study
(BioMed Central, 2016-08-22)
[Abstract]
Background. Disparate and contradictory results make studies necessary to investigate in more depth the relationship between diagnostic delay and survival in colorectal cancer (CRC) patients. The aim of this ...
Developing a system for advanced monitoring and intelligent drug administration in critical care units using ontologies
(IOS Press, 2013-04-27)
[Abstract] When a patient enters an intensive care unit (ICU), either after surgery or due to a serious clinical condition, his vital signs are continually changing, forcing the medical experts to make rapid and complex ...
Nanoinformatics: Developing New Computing Applications for Nanomedicine
(Springer, 2012)
Nanoinformatics has recently emerged to address the need of computing applications at the nano level. In this regard, the authors have participated in various initiatives to identify its concepts, foundations and challenges. ...
Carbon nanotubes’ effect on mitochondrial oxygen flux dynamics: polarography experimental study and machine learning models using star graph trace invariants of Raman spectra
(MDPI, 2017-11-11)
[Abstract] This study presents the impact of carbon nanotubes (CNTs) on mitochondrial oxygen mass flux (Jm) under three experimental conditions. New experimental results and a new methodology are reported for the first ...
Parallel computing for brain simulation
(Bentham Science, 2017-05-01)
[Abstract] Background: The human brain is the most complex system in the known universe, it is therefore one of the greatest mysteries. It provides human beings with extraordinary abilities. However, until now it has not ...