Computational characterization and prediction of metal-organic framework properties [PDF]
, 2015 In this introductory review, we give an overview of the computational chemistry methods commonly used in the field of metal-organic frameworks (MOFs), to describe or predict the structures themselves and characterize their various properties, either at ...
Coudert, François-Xavier +1 more
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Nature Communications, 2023 Covalent organic frameworks (COFs) represent an emerging class of organic photocatalysts. However, their complicated structures lead to indeterminacy about photocatalytic active sites and reaction mechanisms.
Zhongshan Chen +8 more
semanticscholar +1 more source
[1,3]/[1,4]-Sulfur atom migration in β-hydroxyalkylphosphine sulfides
Beilstein Journal of Organic Chemistry, 2020 β-Hydroxyalkylphosphine sulfides undergo [1,3]- or [1,4]-sulfur atom phosphorus-to-carbon migration in the presence of Lewis or Brønsted acids. The direction of sulfur atom migration depends on the type of acid used for the reaction. In the presence of a
Katarzyna Włodarczyk +2 more
doaj +1 more source
Behaviours of natural organic matter in membrane filtration for surface water treatment : a review [PDF]
, 2006 Membrane application in surface water treatment provides many advantages over conventional treatment. However, this effort is hampered by the fouling issue, which restricts its widespread application due to increases in hydraulic resistances, operational
Ismail, A. F. +2 more
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Examining Challenges that Students Face in Learning Organic Chemistry Synthesis
IJCER (International Journal of Chemistry Education Research), 2020 Organic chemistry is the offered after general chemistry and is the course that many find it challenging and difficult. Synthesis is first introduced in organic chemistry I course and is widely considered as one of the topics in which students struggle ...
Issa I. Salame +2 more
doaj +1 more source
MIANN models in medicinal, physical and organic chemistry [PDF]
, 2013 [Abstract] Reducing costs in terms of time, animal sacrifice, and material resources with computational methods has become a promising goal in Medicinal, Biological, Physical and Organic Chemistry. There are many computational techniques that can be used
Arrasate, Sonia +7 more
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iScience, 2020 Summary: The Hantzsch and free-radical polymerization reactions were combined in a one-pot high-throughput (HTP) system to simultaneously prepare 30 unique polymers in parallel.
Guoqiang Liu +7 more
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Diverse Biological Activity of Benzofuroxan/Sterically Hindered Phenols Hybrids
Pharmaceuticals, 2023 Combining two pharmacophores in a molecule can lead to useful synergistic effects. Herein, we show hybrid systems that combine sterically hindered phenols with dinitrobenzofuroxan fragments exhibit a broad range of biological activities.
Elena Chugunova +18 more
doaj +1 more source
A Perspective on the Synthesis, Purification, and Characterization of Porous Organic Cages [PDF]
, 2016 [Image: see text] Porous organic cages present many opportunities in functional materials chemistry, but the synthetic challenges for these molecular solids are somewhat different from those faced in the areas of metal–organic frameworks, covalent ...
Briggs, Michael E, Cooper, Andrew I
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Methods for the synthesis of polyhydroxylated piperidines by diastereoselective dihydroxylation: Exploitation in the two-directional synthesis of aza-C-linked disaccharide derivatives [PDF]
, 2005 Background: Many polyhydroxylated piperidines are inhibitors of the oligosaccharide processing enzymes, glycosidases and glycosyltransferases. Aza-C-linked disaccharide mimetics are compounds in which saturated polyhydroxylated nitrogen and oxygen ...
Adam Nelson +8 more
core +3 more sources