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1.
J Mol Graph Model ; 115: 108202, 2022 09.
Article in English | MEDLINE | ID: mdl-35568006

ABSTRACT

Molecular dynamics simulations were used to investigate the initial stage of phase separation mechanisms for an oversaturated electrolytic solution. We developed a low computational cost methodology to determine the simulation frames where the first ionic clusters are formed. By discretizing the simulation box, we obtain a density profile in the moments preceding and succeeding the nuclei's formation. The growth of the clusters identified with our methodology was analyzed until the end of the simulation. Calculation of the Steinhardt parameter showed symmetry of the solid, giving indications that the classical nucleation theory explains the mechanism of the solid formation. The methodology developed was useful for identifying phase separation mechanisms in the nucleation process. At lower concentrations, there was no formation of stable clusters. At intermediate concentrations, the analyses indicate a transition of phases in one stage, from a oversaturate electrolytic solution to a crystalline solid. At high concentration, a transition of phases in two stages, initially, is the formation of a dense liquid, and only after that, crystalline solid formed inside the dense liquid. The change in phase separation mechanism due to increasing oversaturation underscores the importance of precise determination of the driving force for phase separation and concentration limits for each mechanism.


Subject(s)
Molecular Dynamics Simulation , Sodium Chloride , Crystallization
2.
J Oral Rehabil ; 43(11): 863-870, 2016 Nov.
Article in English | MEDLINE | ID: mdl-27611605

ABSTRACT

More studies evaluating the outcome of dental implant restorations in diabetics are needed. To investigate the outcome of immediate function implant rehabilitations in diabetic patients. This retrospective cohort study included 70 diabetic patients (type 1 = six patients; type 2 = 64 patients; 33 females and 37 males, mean age=59 years), rehabilitated with 352 implants. Primary outcome measure was implant survival estimated at 5 years through the Kaplan-Meier product limit estimator using the patient as unit of analysis (first implant failure as reference); secondary outcome measures were marginal bone loss and biological complications. Risk indicators associated with bone loss >2·0 mm were tested in a multivariate logistic regression model. The level of significance considered was 5%. Seven patients were lost to follow-up (10%). Seven patients lost ten implants rendering a global implant cumulative survival rate for diabetic patients of 89·8% (type 1 = 80·0%; type 2 = 90·5%). The average (95% confidence interval) marginal bone loss at 1 and 5 years was 1·64 mm (0·00;3·32) and 2·55 mm (1·38;3·72) for type 1 diabetic patients, 0·79 mm (0·59;1·00) and 1·45 mm (1·09;1·82) for type 2 diabetic patients and 0·88 mm (0·65;1·10) and 1·56 mm (1·21;1·91) overall. Biological complications occurred in seven patients. Female gender (OR = 28·1) and smoking habits (OR = 10·3) were risk indicators for marginal bone loss >2·0 mm at 5 years when controlled for other variables of interest. Implant rehabilitations represent a valid treatment for diabetic patients, with a good risk/benefit ratio. Female gender and smoking habits were risk indicators for a higher marginal bone resorption at 5 years.


Subject(s)
Alveolar Bone Loss/prevention & control , Dental Implants , Dental Prosthesis, Implant-Supported , Diabetes Complications/prevention & control , Diabetes Mellitus/surgery , Adult , Aged , Aged, 80 and over , Alveolar Bone Loss/physiopathology , Blood Glucose , Diabetes Mellitus/physiopathology , Female , Humans , Male , Middle Aged , Portugal/epidemiology , Practice Guidelines as Topic , Retrospective Studies , Risk Factors
4.
Braz. j. med. biol. res ; 22(4): 477-83, 1989. ilus, tab
Article in English | LILACS | ID: lil-72490

ABSTRACT

1. Surgical time, amylase activiry and pancreatic protein, DNA and RNA content were measured in 38 control rats and in 104 rats injected with sodium taurocholate to induced acute pancreatitis after 21 days on one of four diets differing in protein, lipid and carbohidrate cocnent. 2. All of the parameters measured were lower in rats with pancreatitis than in controls maintained on thes same diets. Among the rats with pancreatitis, those reciving a protein-free survived longer and had significantly higher DNA, lower amylase activity and lower RNA and protein levels than those reciving a balanced diet or one that was high in protein or lipid content. 3. We conclude that acute pancratitis in rats has a more benign course in protein-undernourished animals


Subject(s)
Rats , Animals , Male , Diet , Pancreatitis/mortality , Taurocholic Acid/pharmacology , Acute Disease , Amylases/blood , Dietary Proteins , Pancreas/enzymology , Pancreatitis/chemically induced , Rats, Inbred Strains
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