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941.
942.
In this paper, we carried out a theoretical study on the active site structures of the Mn-SOD with ab initio Hartree–Fock SCF method, and analyzed the molecular orbital energies, charges and atomic orbital contribution to the frontier molecular orbital.  相似文献   
943.
A nondestructive instrumental neutron activation technique was used to analyze human hair samples collected from people living in metropolitan and rural areas in Korea. Samples were also collected from factory workers and cancer patients. Hair from metropolitan area residents contain higher concentrations of Ca, Mg, Zn, Cu, Na, Br, Mn, I and S than rural area residents. Concentrations of I and S from cancer patients, Mg, Zn, Al, Na, Mn and As from glassware workers were relatively higher. The results show that the trace element concentrations of the hair are possibly related to the trace element concentrations in the body.  相似文献   
944.
The use of laser ablation inductively coupled mass spectrometry (laser ICP-MS), in combination with a calibration procedure involving the addition of enriched isotopes, for the determination of trace elements in birch leaves and their ashes is described. Samples are pressed into pellets without binder materials and analyzed using the ICP-MS spectrometer ELAN 5000 with the laser sampler type 320 (Perkin Elmer). The analytical results obtained by two methods are compared with the values obtained after digestion of the same samples and analysis of the resulting solutions by ICP-MS. The results are discussed in terms of precision, accuracy and limits of detections.  相似文献   
945.
946.
947.
Intravascular clot formation is an important factor in a number of cardiovascular diseases. Therefore, the prevention of blood coagulation has become a major target for new therapeutic agents. One attractive approach is the inhibition of factor Xa (FXa), which is a key enzyme in coagulation cascade responsible for the generation of thrombin by limited proteolysis of its zymogen, prothrombin. We have investigated 1-arylsulfonyl-3-piperazinone derivatives, containing a 4-(piperidino)pyridine group in place of guanidino and/or amidino groups, and discovered compound M55113 (30a: 4-[(6-Chloro-2-naphthalenyl)sulfonyl]-1-[[1-(4-pyridinyl)-4-piperidinyl]methyl]piperazinone), as a potent inhibitor of FXa (IC50=0.06 microM) with high selectivity for FXa over trypsin and thrombin.  相似文献   
948.
The synthesis, biological evaluation, and molecular modeling of two conformationally restricted analogues of adenophostinA (1), denominated as spirophostin (3R)-10 and (3S)-11, as novel ligands for the D-myo-inositol 1,4,5-trisphosphate receptor (IP3R), is presented. These diastereoisomeric spiroketals are synthesized by spiroketalization of D-glucose derivatives (2S)-15 and (2R)-16, separation of the protected isomers (3R)-19 and (3S)-20, followed by phosphorylation and deprotection. The spirophostins (3R)-10 and (3S)-11 display comparable biological activity, with a 3H-IP3-displacing and Ca2+-releasing potency less than IP3 and adenophostin A.  相似文献   
949.
Three novel tridentate Schiff base ligands derived fromthe 3-hydroxysalicylaldehyde (H2L1), 4-hydroxysalicylaldehyde (H2L2) and 5-bromosalicylaldehyde (H2L3) with a new amine N-(pyridyl)-2-hydroxy-3-methoxy-5-aminobenzylamine (2) have been prepared. The ligands and their metal complexes have been characterized by elemental analyses, conductivity and magnetic susceptibility measurements, i.r., electronic absorption and 1H and 13C n.m.r. spectroscopy. All complexes are binuclear and, in some, the H2O molecules are coordinated to the metal ion. Antimicrobial activities of the ligands and their complexes have been tested against to the Bacillus subtilis IMG 22 (bacteria), Micrococcus luteus LA 2971 (bacteria) Saccharamyces cerevisiae WET 136 (yeast), and Candida albicans CCM 314 (yeast). Thermal properties of all complexes have been studied by t.g. and d.t.a techniques.  相似文献   
950.
Summary Seven Asian countries have been collaborating in collecting airborne particulate matter (APM) in their individual countries and analyzing them by neutron activation analysis as a common analytical tool. APM samples were collected into two fractions of fine and coarse grains (PM2 and PM2-10, respectively). Analytical data were compared from several viewpoints such as particulate sizes, locality of sampling sites (either urban or rural) and geographical location of participating countries. Chemical composition and their monthly variations as well as mass concentrations appear to be highly characteristic for individual sampling sites, suggesting that NAA data are suitable for evaluating the air quality in each site.  相似文献   
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