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1.
Sensors (Basel) ; 23(21)2023 Oct 24.
Article in English | MEDLINE | ID: mdl-37960371

ABSTRACT

The assessment of food and industrial crops during harvesting is important to determine the quality and downstream processing requirements, which in turn affect their market value. While machine learning models have been developed for this purpose, their deployment is hindered by the high cost of labelling the crop images to provide data for model training. This study examines the capabilities of semi-supervised and active learning to minimise effort when labelling cotton lint samples while maintaining high classification accuracy. Random forest classification models were developed using supervised learning, semi-supervised learning, and active learning to determine Egyptian cotton grade. Compared to supervised learning (80.20-82.66%) and semi-supervised learning (81.39-85.26%), active learning models were able to achieve higher accuracy (82.85-85.33%) with up to 46.4% reduction in the volume of labelled data required. The primary obstacle when using machine learning for Egyptian cotton grading is the time required for labelling cotton lint samples. However, by applying active learning, this study successfully decreased the time needed from 422.5 to 177.5 min. The findings of this study demonstrate that active learning is a promising approach for developing accurate and efficient machine learning models for grading food and industrial crops.


Subject(s)
Machine Learning , Supervised Machine Learning , Random Forest , Problem-Based Learning
2.
Front Plant Sci ; 13: 916734, 2022.
Article in English | MEDLINE | ID: mdl-35646020

ABSTRACT

This current study was performed to determine the influences of plant spacing, Nitrogen (N) fertilization rate and their effect, on growth traits, yield, and yield components of cotton (Gossypium barbadense L.) cv. Giza 97 during the 2019 and 2020 seasons. A split plot experiment in three replicates was utilized whereas the cotton seeds were planted at 20, 30, and 40 cm, as main plots and nitrogen at 75, 100, and 125%, was in subplots. The results revealed that the planting spacing at 40 cm significantly (p ≤ 0.01) increased plant height, number of fruiting branches per plant, number of bolls per plant, boll weight (BW), lint percentage (L%), seed cotton yield (SCY), lint cotton yield (LCY), seed index and lint index by 165.68 cm, 20.92, 23.93, 3.75 g, 42.01%, 4.24 ton/ha, 5.16 ton/ha, 12.05, 7.86, respectively, as average in both seasons. The application of N fertilizer rate at 125% caused a maximum increase in growth and yield parameters i.e., plant height (169.08 cm), number of vegetative branches (2.67), number of fruiting branches per plant (20.82), number bolls per fruiting branch (1.39), number of bolls per plant (23.73), boll weight (4.1 g), lint percent (41.9%), seed index (11.8 g), and lint index (8.2), while the plants treated with 100% N rates exhibited highest seed cotton yield (4.3 ton/ha) and lint cotton yield (5.6 ton/ha), as average in both seasons. Combining plant spacing at 40 cm between plants with a 100% N fertilizer rate recorded the highest lint cotton yield (5.67 ton/ha), while the highest seed cotton yield (4.43 and 4.50 ton/ha) was obtained from 125% N fertilizer rate under planting spacing 20 and 40 cm, respectively. Conclusively, a wide density (40 cm) with 125% N is a promising option for improved biomass, cotton growth, yield, physiological traits, and fiber quality.

3.
Front Plant Sci ; 13: 791066, 2022.
Article in English | MEDLINE | ID: mdl-35615130

ABSTRACT

Rice (Oryza sativa L.) is one of the major cereal crops worldwide with wheat and maize. A total of two field experiments were performed to evaluate the response of some rice cultivars to various foliar zinc (Zn) concentrations based on different measurements, such as agronomic, yield, yield compounds, and grain technological parameters. The experimental layout was a split plot in three replicates; the five rice cultivars (Skaha 101, Giza178, Yasmeen, Fourate, and Amber 33) were distributed in the main plots while the four foliar applications of Zn (1,500, 2,000, 2,500 mg/L besides spray water) were occupied the sub-plots. The findings showed significant differences among the five rice cultivars regarding plant height, grain yield, straw yield, biological yield, harvest index, 1,000-grain weight, panicle length, protein percentage, and grain Zn content. There is a significant effect of Zn on all plant attributes. A significant interaction between rice cultivars and foliar application of Zn was observed, whereas fertilizing Giza 178 with foliar application of Zn at the rate of 2,500 mg/L achieved the highest mean values of grain yield and straw yield, biological yield, harvest index, 1,000-grain weight, panicle length, protein %, and Zn content followed by Sakha 101 with Zn application at the rate of 2,000 mg/L, respectively, in both seasons. The rice cultivars significantly differed in hulling (%), broken (%), hardness, grain length, shape, amylose (%), gel consistency, and gelatinization temperature. Unfortunately, the commercial Zn product used was genotoxic to pollen grains with a higher rate of Zn. Aberrations were observed such as stickiness, ultrastructural changes in the exterior and interior walls, partially or fully degenerated grains, and shrunken and unfilled grains. This study concluded that using Zn application at the rate of 2,000 mg/L to protect human and environmental health, the side effects and toxicity of the local commercial Zn product market should be investigated before making recommendations to farmers.

4.
Eur Arch Paediatr Dent ; 21(1): 75-84, 2020 Feb.
Article in English | MEDLINE | ID: mdl-31124082

ABSTRACT

AIM: This study quantitatively investigated the changes in enamel mineral content of primary teeth after immersion in human breast milk and plain and probiotic-containing infant formulas. METHODS: Thirty-six sound primary anterior teeth were collected and assessed for mineral content (calcium and phosphorus content in wt%) using scanning electron microscope attached with energy-dispersive X-ray analyser (SEM-EDXA). In order to create a microbial-induced caries model, the enamel surfaces of the teeth were inoculated with mutans streptococci and then each tooth was randomly assigned to one of three groups: human breast milk, plain infant formula or probiotic-containing infant formula (n = 12) each. Teeth were then soaked in the designated type of milk, and the solutions were replenished every day for 1 week after which the mineral content was measured again using SEM-EDXA. Wilcoxon signed-rank test was used to study the changes by time within each group, and the significance level was set at P ≤ 0.05. RESULTS: Treatment of enamel surface with breast milk has significantly increased mean Ca wt%, while no significant changes were detected in mean P wt%. On the other hand, when primary teeth were soaked in plain or probiotic-containing infant formulas, both mean values of both Ca and P wt% significantly decreased. CONCLUSIONS: In conclusion, whereas breast milk might confer some protective effect against enamel demineralisation, infant formulas whether plain or supplemented with some probiotics might promote loss of minerals from enamel surface.


Subject(s)
Infant Formula , Probiotics , Animals , Dental Enamel , Female , Humans , Infant , Milk, Human , Minerals , Tooth, Deciduous
5.
Carbohydr Polym ; 198: 119-123, 2018 Oct 15.
Article in English | MEDLINE | ID: mdl-30092981

ABSTRACT

A water soluble, non-gel, poly (N-vinyl-2-pyrrolidone)/κ-carrageenan (PVP/KC) hybrid was synthesized by graft copolymerization of N-vinylpyrrolidone (VP) onto κ-carrageenan in an aqueous medium using ammonium persulphate (APS) as an initiator. Factors affecting the polymerization reaction such as ammonium persulfate concentration, reaction temperature and time, liquor to KC ratio (LR) and KC to VP molar ratio were studied. The results obtained revealed that the optimum reaction polymerization conditions to prepare that hybrid with a total conversion of 93.9% are: [VP], 0.1799 mol/L; VP/KC molar ratio, 50%; [APS], 0.0105 mol/l; LR, 15 l/k; reaction temperature, 90 °C and reaction time, 75 min. Moreover, the grafted KC of that hybrid was characterized via investigating its FTIR analysis. Furthermore, the potential application of such hybrid as a route for synthesis of silver nanoparticles (Ag NPs) using AgNO3 as a precursor was investigated. The synthesized Ag NPs are characterized using the ultraviolet-visible spectroscopy (UV-vis) as well as transmission electron microscope (TEM). The UV-vis showed a band at 435 nm that confirms the presence of Ag NPs. The TEM image shows that such nanoparticles have a spherical structure with an average size ranging from 3 -18 nm.

6.
Int J Biol Macromol ; 114: 929-934, 2018 Jul 15.
Article in English | MEDLINE | ID: mdl-29596934

ABSTRACT

Novel wound dressings composed of non-woven cotton (NWC) fabric and multilayer of hyaluronan (HA) and chitosan were built using layer-by-layer assembly technique. Factors affecting the building up of that dressings such as HA concentration, number of coating layers and nitrogen content of the NWC fabric quaternized form were studied. Meanwhile, some physico-chemical properties of such dressings were investigated. Moreover, to enhance the antibacterial properties of the aforementioned dressings, Silver nano-particles (Ag NPs) were prepared and incorporated as a functional additive in the final HA layer of such dressings. Factors affecting the building up of that dressings such as HA concentration, number of coating layers and nitrogen content of the NWC fabric quaternized form were studied. The results obtained showed that: i) increasing of HA concentration from 0.25 to 1.0% is accompanied by a gradual reduction in the swelling properties and an improvement in the gel fractionas as well as antibacterial properties of treated fabric along with a decreasing in extents of stiffness, air permeability and the relative water vapor permeability of treated fabric, ii) increasing of steeping time of coated samples results in an improvement in percent swelling of these samples. TEM image of the prepared Ag-NPs depicts that the particle size of that nano-particles was <13nm. Furthermore, the prepared dressing surface was characterized via scanning electron microscope. The EDX of Ag NPs loaded dressings confirmed the presence of Ag NPs onto such dressings with Ag - content of 0.24% (w/w). The thermogravimetric analysis assured that the prepared dressings based on quaternized NWC fabric have higher thermal stability than the un-quaternized form.


Subject(s)
Bandages , Chitosan/chemistry , Coated Materials, Biocompatible/chemistry , Cotton Fiber , Hyaluronic Acid/chemistry , Metal Nanoparticles/chemistry , Silver/chemistry
7.
Bratisl Lek Listy ; 113(1): 14-8, 2012.
Article in English | MEDLINE | ID: mdl-22380495

ABSTRACT

OBJECTIVES: This study was conducted to determine the association of insertion/deletion (I/D) polymorphism of the ACE gene in hypertensive and T2DM subjects in Egyptian population. BACKGROUND: The deletion (D) allele of the angiotensin-converting enzyme (ACE) gene has been studied in relation to hypertension and type 2 diabetes mellitus (T2DM) with contradictory results which might be due to ethnic and geographical variations. METHODS: A total of 85 subjects participated in this study; hypertension (Group 1); type 2 diabetes mellitus (Group 2) and controls (Group 3). Written informed consent was obtained. for each subject: age, sex, diabetes duration and the drugs used, blood pressure (systolic and diastolic), and lipid profile. Genotyping was performed by polymerase chain reaction (PCR). RESULTS: The frequency of DD genotype was significantly higher in hypertensive (60 %) and diabetic patients (68 %) compared to controls (33.3 %) (p=0.04, p=0.01 respectively). The DD genotype (vs DI and II genotype) in the hypertensive and diabetic groups is associated with increased risk of hypertension and/or diabetes. OR=3.00; 95%, Cl = 0.993-9.067; OR=4.250; 95%, Cl = 1.234-14.63 respectively). The D allele was more frequent in hypertensive (77.5 %) and diabetic patients (82 %) compared to controls (52.4 %) (p=0.004 and 0.002 respectively). The D allele (vs the I allele) is associated with increased risk of hypertension and diabetes OR=3.13, 95%Cl=1.405-6.978; OR= 4.14, 95% CI= 1.615-10.622 respectively). CONCLUSION: The DD genotype and the D allele are associated with hypertension and type 2 diabetes in Egyptian patients (Tab. 5, Fig. 1, Ref. 32).


Subject(s)
Diabetes Mellitus, Type 2/genetics , Hypertension/genetics , Peptidyl-Dipeptidase A/genetics , Polymorphism, Genetic , Female , Gene Frequency , Genotype , Humans , Male , Middle Aged
8.
J Mol Graph Model ; 28(6): 478-86, 2010 Feb 26.
Article in English | MEDLINE | ID: mdl-20036171

ABSTRACT

A computational study using several ab initio methods, HF, DFT and MP2 at different basis set levels (6-31G*, 6-31G**, 6-311G** and 6-311++G**) has been performed to determine the possible stable conformations attained by the cephalosporin nucleus. The calculations were carried out in three stages by studying the conformational analysis of the 3-cephem nucleus, the 3-cephem-4-carboxylic acid nucleus and the acetylamino group of the 7-acetylamino-3cephem-4-carboxylic acid. In the first two stages, the potential energy surfaces indicated two minima that correspond to the S1-up and C2-up conformations, with the S1-up being more stable. The energy required for the interconversion of the S1-up to the C2-up is around 7 kcal/mol, indicating the feasibility of interconversion between the two conformers. In the third stage, the acetylamino group attained two conformations with respect to the 3-cephem nucleus. All the geometric parameters obtained in this study were found to be in reasonably good agreement with available X-ray diffraction data, even upon using a simple basis set.


Subject(s)
Cephalosporins/chemistry , Models, Chemical , Quantum Theory , Carboxylic Acids/chemistry , Models, Molecular , Molecular Conformation , Thiazines/chemistry
9.
J Mater Sci Mater Med ; 18(3): 523-8, 2007 Mar.
Article in English | MEDLINE | ID: mdl-17334704

ABSTRACT

High quality heating device made of ferromagnetic alloy (thermal seed) was developed for hyperthermia treatment of cancer. The device generates sufficient heat at room temperature and stops heating at the Curie temperature T (c). The power dissipated from each seed was calculated from the area enclosed by the hysteresis loop. A new mathematical formula for the calculation of heating power was derived and showed good agreement with those calculated from hysteresis loop and calorimetric method.


Subject(s)
Alloys , Biocompatible Materials , Ferric Compounds , Hyperthermia, Induced/methods , Cobalt , Copper , Hot Temperature , Humans , In Vitro Techniques , Materials Testing , Models, Theoretical , Neoplasms/therapy , Nickel , Palladium
10.
Mycobiology ; 34(2): 99-103, 2006 Jun.
Article in English | MEDLINE | ID: mdl-24039478

ABSTRACT

Toxicity of the fungicide Flutolanil was in vitro tested against 20 isolates of Macrophomina phaseolina and cotton seedlings of ten commercial cotton cultivars. The isolates were recovered from roots of cotton plants obtained from different cotton-growing areas in Egypt. Most of the tested isolates were sensitive to Flutolanil; however, they varied in sensitivity. Twenty-five percent of the isolates were highly sensitive where IC50 ranged from < 1 to 5.1 µg/ml, 20% of the isolates were sensitive where IC50 ranged from 15 to 30 µg/ml, 45% of the isolates were moderately sensitive where IC50 ranged from 46 to 58.5 µg/ml, and 10% of the isolates were not much sensitive (tolerant) where IC50 was > 100 µg/ml. Flutolanil was very safe on both shoots and roots of the tested cultivars (IC50 > 100 µg/ml). Treating cotton seeds with Flutolanil resulted in highly significant (P < 0.01) reductions in pathogenicity of 18 isolates and a significant reduction (P < 0.05) in pathogenicity of isolate M29. M1 was the only isolate, which was insensitive to the application of Flutolanil. In vivo toxicity to Flutolanil was not correlated with its in vitro toxicity. However, a highly significant correlation (r = 0.60, P < 0.01) was observed between pathogenicity of isolates and the in vivo toxicity of the fungicide.

11.
Bioelectrochemistry ; 65(2): 95-104, 2005 Feb.
Article in English | MEDLINE | ID: mdl-15713559

ABSTRACT

Both osteryoung square wave voltammetry and cyclic voltammetry have been utilized to elucidate and confirm the possible complexation reaction that occur between the various cephalosporin antibiotics and either the toxic, non-essential metal ion, viz. Cd (II), or the essential but toxic (when their concentration exceeds certain level in serum) metal ions, viz. Cu (II) and Zn (II). Voltammetric measurements indicated the existence of 1:1 metal-to-ligand ratio (as in cephalexin and cephapirin complexes), 1:2 ratio (such as in cefamandole, cefuroxime and cefotaxime complexes) and 2:1 ratio in case of ceftazidime complexes. Adsorption behavior was evidenced for Cu (II)-cefuroxime or ceftazidime complexes as well as for those for Zn (II)-cephalexin or cephapirin. This phenomenon could be used for the determination of either the antibiotic or the metal ion using adsorptive stripping voltammetry. Detection limits down to 7x10(-10) M have been easily achieved.


Subject(s)
Cephalosporins/chemistry , Electrochemistry , Organometallic Compounds/chemistry , Transition Elements/chemistry , Cadmium/chemistry , Copper/chemistry , Ligands , Zinc/chemistry
12.
Folia Microbiol (Praha) ; 48(1): 51-5, 2003.
Article in English | MEDLINE | ID: mdl-12744076

ABSTRACT

Given the significant low yield (19-43%) in reported results on the cyclocondensation of sulfaguanidine acetate with chalcones, a careful reinvestigation was carried out. A new series of chalcones, bearing electron-attracting groups in the aromatic moiety, have been used as precursors in the synthesis of diphenylsulfapyrimidine acetates with good yield. All synthesized compounds were active against G(+)- and G(-)-bacteria, and fungi. Combination of substituents (Cl, OMe, NO2, etc.) enhanced antimicrobial activity. Derivative with two NO2 groups exhibits an activity comparable with sulfadiazine.


Subject(s)
Anti-Infective Agents/chemical synthesis , Chalcone/chemistry , Pyrimidines/chemical synthesis , Sulfonamides/chemical synthesis , Acetates/chemical synthesis , Acetates/chemistry , Acetates/pharmacology , Anti-Bacterial Agents , Anti-Infective Agents/chemistry , Anti-Infective Agents/pharmacology , Fungi/drug effects , Gram-Negative Bacteria/drug effects , Gram-Positive Bacteria/drug effects , Microbial Sensitivity Tests , Pyrimidines/chemistry , Pyrimidines/pharmacology , Structure-Activity Relationship , Sulfaguanidine/chemistry , Sulfonamides/chemistry , Sulfonamides/pharmacology
13.
Folia Microbiol (Praha) ; 47(2): 131-6, 2002.
Article in English | MEDLINE | ID: mdl-12058390

ABSTRACT

3-(1,1-Dioxadibenzothien-4-oyl)acrylic acid (1) was condensed with compounds containing active methylene groups under Michael reaction conditions to furnish the Michael adducts (lactones 2a-c, lactams 3a-c, ketones 4a,b). The behavior of these adducts toward the action of hydrazine hydrate were investigated. The compounds were tested for their biological properties.


Subject(s)
Acrylates/chemical synthesis , Acrylates/pharmacology , Carboxylic Acids/chemical synthesis , Acrylates/chemistry , Bacteria/drug effects , Carboxylic Acids/chemistry , Carboxylic Acids/pharmacology , Microbial Sensitivity Tests , Spectrum Analysis
14.
J Infect Dis ; 183(11): 1694-7, 2001 Jun 01.
Article in English | MEDLINE | ID: mdl-11343222

ABSTRACT

Previous work divided serotype III group B streptococci (GBS) into 3 major phylogenetic lineages (III-1, III-2, and III-3) on the basis of bacterial DNA restriction digest patterns (RDPs). Most neonatal invasive disease was caused by III-3 strains, which implies that III-3 strains are more virulent than III-2 or III-1 strains. In the current studies, all RDP III-3 and III-1 strains expressed hyaluronate lysase activity; however, all III-2 strains lack hyaluronate lysase activity, because the gene that encodes hyaluronate lysase, hylB, is inactivated by IS1548. Subtractive hybridization was used to identify 9 short DNA sequences that are present in all the III-3 strains but not in any of the III-2 or III-1 strains. With 1 exception, these III-3-specific sequences were not detected in nonserotype III GBS. These data further validate the RDP-based subclassification of GBS and suggest that lineage-specific genes will be identified, which account for the differences in virulence among the lineages.


Subject(s)
Polysaccharide-Lyases/genetics , Streptococcus/genetics , Blotting, Southern , DNA Restriction Enzymes , DNA Transposable Elements , DNA, Bacterial/analysis , DNA, Bacterial/genetics , Humans , Nucleic Acid Hybridization , Phylogeny , Polysaccharide-Lyases/chemistry , Sequence Analysis, DNA , Streptococcus/classification , Streptococcus/enzymology , Virulence/genetics
15.
Infect Immun ; 68(9): 5018-25, 2000 Sep.
Article in English | MEDLINE | ID: mdl-10948119

ABSTRACT

Many group B Streptococcus agalactiae strains and other pathogenic streptococci express a cell-associated peptidase that inactivates C5a (C5a-ase), the major neutrophil chemoattractant produced by activation of the complement cascade. Type III group B streptococci (GBS) can be classified genotypically into three restriction digest pattern types. Functional C5a-ase activity of GBS correlates with this genetic typing; therefore, we sought to identify a genetic basis for this phenomenon. Southern hybridization confirms that all type III GBS contain scpB, the gene encoding GBS C5a-ase. GBS strains with high C5a-ase functional activity and those with no or very low activity both express immunoreactive C5a-ase. The scpB sequence of strain I30, which has high C5a-ase activity, is 98.2% homologous to the previously reported serotype II GBS scpB sequence. The scpB sequences of strains I25 and GW, which have low or no C5a-ase activity, are identical. The predicted I25 and GW C5a-ase proteins share a four-amino-acid deletion affecting the protease histidine active-site consensus motif. Recombinant I30 C5a-ase has good functional activity, whereas recombinant I25 C5a-ase has low activity. These data demonstrate that functional C5a-ase differences between type III GBS strains are attributable to a genetic polymorphism of scpB. The ubiquitous expression of C5a-ase, irrespective of functional activity, suggests that C5a-ase may have a second, as yet unidentified, function.


Subject(s)
Adhesins, Bacterial , Endopeptidases/genetics , Genes, Bacterial , Polymorphism, Genetic , Streptococcus agalactiae/genetics , Amino Acid Sequence , Animals , Antibodies, Monoclonal/immunology , Bacterial Vaccines/immunology , Endopeptidases/chemistry , Endopeptidases/physiology , Mice , Mice, Inbred BALB C , Molecular Sequence Data , Streptococcus agalactiae/immunology
16.
IEEE Trans Neural Netw ; 10(2): 419-26, 1999.
Article in English | MEDLINE | ID: mdl-18252539

ABSTRACT

Presented in this paper is a new methodology for detection of neural-network gaps (NNG's) based on error analysis and the visualization that is applicable for n-dimensional I/O domain. The generalization problem in artificial neural networks (ANN) training is analyzed and the concept of NNG's is introduced. The NNG's are highly undesirable in ANN generalization and methods for detecting, analyzing, and eliminating them are necessary. Previous methods for NNG detection, based on two-dimensional (2-D) and three-dimensional (3-D) visualization, were not applicable for ANN's with more than three inputs. Experiments demonstrate advantages of this new methodology, which allows better understanding of the NNG phenomena using a quantitative approach.

18.
Med J Aust ; 165(10): 553-6, 1996 Nov 18.
Article in English | MEDLINE | ID: mdl-8941241

ABSTRACT

OBJECTIVE: To examine management of cellulitis in a tertiary teaching hospital, identify inefficiencies and suggest revised management guidelines. DESIGN: Retrospective case survey, based on patient hospital records. SETTING: Heidelberg Repatriation Hospital, Melbourne, Victoria (a tertiary teaching hospital), in 1991 and 1992. SUBJECTS: All patients admitted with lower-limb cellulitis as the primary diagnosis. RESULTS: 118 patients were included. Underlying disease predisposing to cellulitis was found in 79%, but was adequately investigated in only 20% of these. Blood cultures were performed in 55%, all with negative results. Other microbiological investigations also had poor yields. Combination therapy with intravenous (i.v.) flucloxacillin and penicillin was given to 76%, with duration varying widely (mean, six days). Where documented (73%), most patients (94%) responded to antibiotics within five days. However, in 40% of patients i.v. therapy was continued for longer and in 10% for 10 days or more, with no significant difference in outcome. Length of hospital stay averaged 13 days, with prolonged stay often associated with surgical intervention or intercurrent problems. However, 15% of patients remained in hospital longer than 10 days for no clear indication. Outpatient review was common (75%), but persistence or relapse of cellulitis was found in only four patients on review. CONCLUSIONS: Management of inpatients with cellulitis is inefficient, with excessive use of microbiological investigations, inadequate investigation and treatment of underlying disease, prolonged use of intravenous antibiotics, unnecessarily long hospital stays, questionable use of combination antibiotic therapy and excessive outpatient review (rather than review by a local medical practitioner).


Subject(s)
Cellulitis/therapy , Adult , Aged , Aged, 80 and over , Anti-Bacterial Agents/therapeutic use , Cellulitis/drug therapy , Female , Hospitals, Teaching , Humans , Leg , Male , Middle Aged , Recurrence , Retrospective Studies , Treatment Outcome
19.
J Chem Technol Biotechnol ; 56(3): 227-31, 1993.
Article in English | MEDLINE | ID: mdl-7763529

ABSTRACT

Technetium-aspirin and technetium-aspirin-like molecule complexes were prepared. The structure of N-acetyl-anthranilic acid (NAA) has been decided through CNDO calculations. The ionization potential and electron affinity of the NAA molecule as well as the charge densities were calculated. Comparative studies of the electronic absorption spectra of acetylthio-salicylic acid (ATS) and aspirin (Asp) reveal the structure resemblance in which the acetyl carbonyl group is perpendicular to the plane of the corresponding organic acid. The studies of the electronic absorption spectra of NAA and anthranilic acid reveal the planarity of the NAA molecule. The electronic absorption spectra of Tc(V)-Asp and Tc(V)-ATS complexes have two characteristic absorption bands at 450 and 600 nm, but the Tc(V)-NAA spectrum has one characteristic band at 450 nm. As a comparative study, Mo-ATS complex was prepared and its electronic absorption spectrum is comparable with the Tc-ATS complex spectrum.


Subject(s)
Aspirin/chemistry , Technetium/chemistry , Aspirin/analogs & derivatives , Chemical Phenomena , Chemistry, Physical , Electrochemistry , Molecular Conformation , Spectrophotometry, Ultraviolet , ortho-Aminobenzoates/chemistry
20.
Arch Pharm (Weinheim) ; 325(10): 625-8, 1992 Oct.
Article in English | MEDLINE | ID: mdl-1466627

ABSTRACT

Claisen reaction of 4-acetyl[2.2]paracyclophane (1) with ethyl acetate and diethyl oxalate affords 4-acetoacetyl[2.2]paracyclophane (2) and ethyl (4-oxaloacetyl[2.2]paracyclophane) (6), respectively. Reaction of 2 and 6 with hydrazines and CuCl2 gave the pyrazole derivatives 4 and 8 in addition to the metal complexes 5 and 9. Mannich reaction of 2 with benzylamine and paraformaldehyde yielded the piperidinone derivative 3. The biological activity of all new compounds was tested.


Subject(s)
Bridged-Ring Compounds/chemical synthesis , Animals , Bridged-Ring Compounds/pharmacology , Culex , Microbial Sensitivity Tests , Molecular Structure , Moths
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