Computational approaches in preclinical studies on drug discovery and development
F Wu, Y Zhou, L Li, X Shen, G Chen, X Wang… - Frontiers in …, 2020 - frontiersin.org
Because undesirable pharmacokinetics and toxicity are significant reasons for the failure of
drug development in the costly late stage, it has been widely recognized that drug ADMET …
drug development in the costly late stage, it has been widely recognized that drug ADMET …
Inflammation and metabolism in cancer cell—mitochondria key player
Cancer metabolism is an essential aspect of tumorigenesis, as cancer cells have increased
energy requirements in comparison to normal cells. Thus, an enhanced metabolism is …
energy requirements in comparison to normal cells. Thus, an enhanced metabolism is …
Fungal enzymes for the degradation of polyethylene: Molecular docking simulation and biodegradation pathway proposal
E Santacruz-Juárez, RE Buendia-Corona… - Journal of Hazardous …, 2021 - Elsevier
Polyethylene (PE) is one of the most highly consumed petroleum-based polymers and its
accumulation as waste causes environmental pollution. In this sense, the use of …
accumulation as waste causes environmental pollution. In this sense, the use of …
Defining the Role of Isoeugenol from Ocimum tenuiflorum against Diabetes Mellitus-Linked Alzheimer's Disease through Network Pharmacology and Computational …
The present study involves the integrated network pharmacology and phytoinformatics-
based investigation of phytocompounds from Ocimum tenuiflorum against diabetes mellitus …
based investigation of phytocompounds from Ocimum tenuiflorum against diabetes mellitus …
Competitive glucose metabolism as a target to boost bladder cancer immunotherapy
J Afonso, LL Santos, A Longatto-Filho… - Nature Reviews …, 2020 - nature.com
Bladder cancer—the tenth most frequent cancer worldwide—has a heterogeneous natural
history and clinical behaviour. The predominant histological subtype, urothelial bladder …
history and clinical behaviour. The predominant histological subtype, urothelial bladder …
Unveiling the intricate supramolecular chemistry of γ-cyclodextrin-epigallocatechin gallate inclusion complexes
Green tea's main polyphenol, epigallocatechin-gallate (EgCg), garners attention for diverse
health-promoting properties. Due to the limited bioavailability of EgCg, drug formulation …
health-promoting properties. Due to the limited bioavailability of EgCg, drug formulation …
Promising phytochemicals of traditional Indian herbal steam inhalation therapy to combat COVID-19–An in silico study
S Gowrishankar, S Muthumanickam… - Food and Chemical …, 2021 - Elsevier
Background COVID-19, the presently prevailing global public health emergency has
culminated in international instability in economy. This unprecedented pandemic outbreak …
culminated in international instability in economy. This unprecedented pandemic outbreak …
[PDF][PDF] Macroalgae bioactive compounds for the potential antiviral of SARS-CoV-2: An in silico study
H Padmi, VD Kharisma, ANM Ansori… - J Pure Appl …, 2022 - researchgate.net
Abstract Coronavirus disease (COVID-19), which was due to novel coronavirus was
detected in December 2019 in Wuhan, China for the first time and spread rapidly became a …
detected in December 2019 in Wuhan, China for the first time and spread rapidly became a …
[HTML][HTML] COVID-19: Rational discovery of the therapeutic potential of Melatonin as a SARS-CoV-2 main Protease Inhibitor
EL Feitosa, FTDSS Júnior, JADON Neto… - … journal of medical …, 2020 - ncbi.nlm.nih.gov
The SARS-CoV-2 spread quickly across the globe. The World Health Organization (WHO)
on March 11 declared COVID-19 a pandemic. The mortality rate, hospital disorders and …
on March 11 declared COVID-19 a pandemic. The mortality rate, hospital disorders and …
In silico Prediction, Characterization, Molecular Docking, and Dynamic Studies on Fungal SDRs as Novel Targets for Searching Potential Fungicides Against …
Vascular wilt of tomato caused by Fusarium oxysporum f. sp. lycopersici (FOL) is one of the
most devastating diseases, that delimits the tomato production worldwide. Fungal short …
most devastating diseases, that delimits the tomato production worldwide. Fungal short …