Quantitative correlation of physical and chemical properties with chemical structure: utility for prediction
AR Katritzky, M Kuanar, S Slavov, CD Hall… - Chemical …, 2010 - ACS Publications
All properties of organic moleculessphysical, chemical, biological, and
technologicalsdepend on their chemical structure and vary with it in a systematic way. The …
technologicalsdepend on their chemical structure and vary with it in a systematic way. The …
Proteochemometric modeling as a tool to design selective compounds and for extrapolating to novel targets
GJP Van Westen, JK Wegner, AP IJzerman… - …, 2011 - pubs.rsc.org
'Proteochemometric modeling'is a bioactivity modeling technique founded on the description
of both small molecules (the ligands), and proteins (the targets). By combining those two …
of both small molecules (the ligands), and proteins (the targets). By combining those two …
Integrated omics analysis of specialized metabolism in medicinal plants
Medicinal plants are a rich source of highly diverse specialized metabolites with important
pharmacological properties. Until recently, plant biologists were limited in their ability to …
pharmacological properties. Until recently, plant biologists were limited in their ability to …
Analysis of widely targeted metabolites of the euhalophyte Suaeda salsa under saline conditions provides new insights into salt tolerance and nutritional value in …
Q Li, J Song - BMC Plant Biology, 2019 - Springer
Abstract Background Suaeda salsa L.(S. salsa) is an annual euhalophyte with high salt
tolerance and high value as an oil crop, traditional Chinese medicine and vegetable …
tolerance and high value as an oil crop, traditional Chinese medicine and vegetable …
Metabolomic analysis with GC-MS to reveal potential metabolites and biological pathways involved in Pb & Cd stress response of radish roots
Y Wang, L Xu, H Shen, J Wang, W Liu, X Zhu… - Scientific reports, 2015 - nature.com
The radish (Raphanus sativus L.) is an important root vegetable crop. In this study, the
metabolite profiling analysis of radish roots exposed to lead (Pb) and cadmium (Cd) stresses …
metabolite profiling analysis of radish roots exposed to lead (Pb) and cadmium (Cd) stresses …
Variable selection methods in QSAR: an overview
MP Gonzalez, C Teran, L Saiz-Urra… - Current topics in …, 2008 - ingentaconnect.com
Variable selection is a procedure used to select the most important features to obtain as
much information as possible from a reduced amount of features. The selection stage is …
much information as possible from a reduced amount of features. The selection stage is …
Systems responses of rats to aflatoxin B1 exposure revealed with metabonomic changes in multiple biological matrices
L Zhang, Y Ye, Y An, Y Tian, Y Wang… - Journal of proteome …, 2011 - ACS Publications
Exposure to aflatoxins causes liver fibrosis and hepatocellular carcinoma posing a
significant health risk for human populations and livestock. To understand the mammalian …
significant health risk for human populations and livestock. To understand the mammalian …
Symbionts protect aphids from parasitic wasps by attenuating herbivore-induced plant volatiles
Plants respond to insect attack by releasing blends of volatile chemicals that attract their
herbivores' specific natural enemies, while insect herbivores may carry endosymbiotic …
herbivores' specific natural enemies, while insect herbivores may carry endosymbiotic …
Model-based design of tailor-made biofuels
M Dahmen, W Marquardt - Energy & Fuels, 2016 - ACS Publications
Oxygenates derived through the selective catalytic refunctionalization of carbohydrates of
lignocellulosic biomass can be tailored to exhibit desired physicochemical fuel properties …
lignocellulosic biomass can be tailored to exhibit desired physicochemical fuel properties …
Trichinella spiralis -induced immunomodulation signatures on gut microbiota and metabolic pathways in mice
XM Sun, CY Hao, AQ Wu, ZN Luo, S El-Ashram… - PLoS …, 2024 - journals.plos.org
The hygiene hypothesis proposes that decreased exposure to infectious agents in
developed countries may contribute to the development of allergic and autoimmune …
developed countries may contribute to the development of allergic and autoimmune …