Formation of interstellar complex polycyclic aromatic hydrocarbons: insights from molecular dynamics simulations of dehydrogenated benzene
The data are supplemental materials for the article entitled "Formation of interstellar complex polycyclic aromatic hydrocarbons: insights from molecular dynamics simulations of dehydrogenated benzene" authored by M. Hanine et al. The data contains: - Atomistic configurations of the formed PAH ...
New spiropyrrolothiazole derivatives bearing an oxazolone moiety as potential antidiabetic agent: Design, synthesis, crystal structure, Hirshfeld surface analysis, ADME and molecular docking studies
In a sustained search for novel and effective antihyperglycemics, a new series of fifteen isomeric oxazolone-fused dispiropyrrolothiazoles resulting from one-pot three component reaction between L-4-thiazolidine carboxylic acid, arylidene-oxazolones and isatin (or acenaphthenequinone) has been ...
Antimicrobial Activity and DFT Studies of a Novel Set of Spiropyrrolidines Tethered with Thiochroman-4-one/Chroman-4-one Scaffolds
A novel series of 14 spiropyrrolidines bearing thiochroman-4-one/chroman-4-one, and oxindole/acenaphthylene-1,2-dione moieties were synthesized and characterized by spectroscopic techniques, as well as by three X-ray diffraction studies, corroborating the stereochemistry. Quantum chemical ...
Synthesis, antidiabetic activity and molecular docking study of rhodanine-substitued spirooxindole pyrrolidine derivatives as novel α-amylase inhibitors
In a sustained search for novel α-amylase inhibitors for the treatment of type 2 diabetes mellitus (T2DM), we report herein the synthesis of a series of nineteen novel rhodanine-fused spiro[pyrrolidine-2,3′-oxindoles]. They were obtained by one-pot three component [3 + 2] cycloaddition of stabilized ...
Pollen analysis - Montlebon (F-25), Sur la Vigne 1 (Morteau A)
Natural site: wet meadow. 99 palynological samples + 4 radiocarbon datings. Drilling of 28.10 meters length.
Pollen analysis - Montlebon (F-25), La Vigne 2
Natural site: wet meadow. 22 palynological samples. From 3,90 to 18,85 meters length: extension of Morteau Stade and Sur la Seigne transect lines.
Pollen analysis - Lavancia-Epercy (F-39), Dortan travertine quarry
Natural site: travertine quarry ("Tuff of Dortan"). 3 palynological samples + 1 radiocarbon dating: 9100 ± 180 BP.
Pollen analysis - Montlebon (F-25), Transect S4
Natural site: wet meadow. 6 palynological samples. From 10.20 to 13.20 meters. Atypical results. Extension of Morteau Stade et Sur la Seigne transect lines.
Pollen analysis - Montlebon (F-25), Sur La Seigne
Natural site: wet meadow. 58 palynological samples + 2 radiocarbon datings. 10,40 meters length.
Pollen analysis - Montlebon (F-25), Transect S3
Natural site: wet meadow. 24 palynological samples. From 4.40 to 25,70 meters length: extension of Morteau Stade and Sur la Seigne transect lines.
Pollen analysis - Morteau (F-25), Transect S2
Natural site; weat meadow. 16 palynological samples. Many drillings along a transect ligne: 6.0 to 12.45 meters length.
Pollen analysis - Morteau (F-25), Transect S1
Natural site; weat meadow. 18 palynological samples. Many drillings along a transect ligne: 4.20 to 12.30 meters length.
Pollen analysis - Morteau (F-25), Stade
Natural site; weat meadow. 62 palynological samples. 12 meters length drilling.
Effect of global warming on the immune system of phytophagous pests
Physiological parameters of the insect immune system (heamocyte, PO, pro PO) Behavioral parameters of larval defense against natural ennemies (activity, flapping) Parameters of insect reproduction (mating success, fecundity, fertility)
WRF-CORDEX simulations on the Mediterranean domain MED-44
WRF-CORDEX simulations on the Mediterranean MED-44 domain at 44 kms resolution. The version of the WRF model is 3.8.1 (Advance Research WRF dynamics (Skamarock et al 2008.)) forced by ERA-interim for the control run and CCSM4 for the scenarios. 4 sets of data are therefore available: the control run ...
WRF-CORDEX simulations on the Europe domain EUR-44
WRF-CORDEX simulations on the European EUR-44 domain at 44 kms resolution. The version of the WRF model is 3.8.1 (Advance Research WRF dynamics (Skamarock et al 2008.)) forced by ERA-interim for the control run and CCSM4 for the scenarios. 4 sets of data are therefore available: the control run over ...
Pollen analysis - Mirebel (F-39), Les Granges Bruant
Natural site. Organic level into the lower river terrace of the Ain river. 3 palynological samples. Presence of Fagus and Juglans pollen grains (= pollution).
Pollen analysis - Châtillon (F-39), Les Ebalèves (varves)
Natural site. Geological section border on the Ain river. 25 palynological samples very low in pollen grains. Other analysis by Bohneke (1987) and Duverne (1958).
Pollen analysis - Charcier (F-39), En Bourand (Varves)
Natural site. Geological section border on the Ain river. Only one nearly sterile palynological sample.
Wikipedia network analysis of cancer interactions and world influence
We apply the Google matrix algorithms for analysis of interactions and influence of 37 cancer types, 203 cancer drugs and 195 world countries using the network of 5 416 537 English Wikipedia articles with all their directed hyperlinks. The PageRank algorithm provides the importance order of cancers ...
Massive evaluation and analysis of Poincaré recurrences
We present a novel numerical method aimed to characterize global behaviour, in particular chaotic diffusion, in dynamical systems. It is based on an analysis of the Poincaré recurrence statistics on massive grids of initial data or values of parameters. We concentrate on Hamiltonian systems, ...
Interactions of pharmaceutical companies with world countries, cancers and rare diseases from Wikipedia network analysis
Using the English Wikipedia network of more than 5 million articles we analyze interactions and interlinks between the 34 largest pharmaceutical companies, 195 world countries, 47 rare renal diseases and 37 types of cancer. The recently developed algorithm of reduced Google matrix (REGOMAX) allows ...
Adsorption of methanol on ice
Data of the Adsorption Isotherm of Methanol on Crystalline (Ih) Ice at 200 K, as Obtained from Grand Canonical Monte Carlo Simulations.
World influence of infectious diseases from Wikipedia network analysis
We consider the network of 5416537 articles of English Wikipedia of 2017. Using the recent reduced Google matrix (REGOMAX) method we construct the reduced network of 230 articles (nodes) of infectious diseases and 195 articles of world countries. This method generates the reduced directed network ...
Wikipedia Ranking of World Universities 2017
We present Wikipedia Ranking of World Universities (WRWU) based on analysis of networks of 24 Wikipedia editions collected in May 2017. With PageRank and CheiRank algorithms we determine ranking of universities averaged over cultural views of these editions. The comparison with the Shanghai ranking ...
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