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1.
Phys Chem Chem Phys ; 25(32): 21649-21660, 2023 Aug 16.
Article in English | MEDLINE | ID: mdl-37551529

ABSTRACT

Diamond tools play a vital role in precision machining. However, the adhesive wear restricts their application when Fe-based workpieces are cut by diamond tools. Thus, it is significant to theoretically explain the interface binding mechanism between the diamond and Fe alloy matrix. In this study, the adhesion and friction behaviors of a γ-Fe/diamond (denoted as Fe/C) heterogeneous contact interface were investigated employing density functional theory (DFT). The results show that the transfer of the Fe atom to C atom occurs when the interaction energy for a given configuration is larger than the separation energy of the corresponding Fe surface layers. The energy barriers of the Fe/C(100), (110) and (111) sliding interfaces along the minimum energy path are 1.45, 0.48 and 0.42 J m-2, respectively, indicating that the Fe/C(111) interface is the easiest to slide. Furthermore, the friction potential barrier increases with an increase in the load (1-5 nN) according to the potential energy curves. Moreover, the friction coefficient of the Fe/C interface is larger than 0.2 and provides a theoretical minimum friction coefficient for the Fe/C sliding interface.

2.
Langmuir ; 38(49): 15113-15120, 2022 Dec 13.
Article in English | MEDLINE | ID: mdl-36441869

ABSTRACT

In this paper, according to the C(111) surface and Ti(112̅0) surface relative positions, three stacking interface models were constructed by the first-principles method, and they were defined as 1st-C(111)/Ti(112̅0), 2nd-C(111)/Ti(112̅0), and 4th-C(111)/Ti(112̅0), respectively. After calculation, the work of interfacial adhesion of the 1st-C(111)/Ti(112̅0), 2nd-C(111)/Ti(112̅0), and 4th-C(111)/Ti(112̅0) interface models is found to be 9.689, 10.246, and 9.714 J/m2, respectively, and their interface energies are observed to be 1.064, 0.507, and 1.039 J/m2, respectively. Moreover, the electronic characteristics of C(111)/Ti(112̅0) interfaces are dominated by polar covalent bonds, supplemented by certain metallicity. When the strain reaches 13, 15, and 12%, respectively, the maximum tensile stress values of 1st-C(111)/Ti(112̅0), 2nd-C(111)/Ti(112̅0), and 4th-C(111)/Ti(112̅0) interface models are observed to be 16.207, 19.183, and 17.393 GPa, respectively. After all C(111)/Ti(112̅0) interfaces fracture under tension, the Ti atoms of the Ti(112̅0) surface are transferred to the C(111) surface, indicating that the strength of Ti-C bonds at the interface is higher than the strength of Ti-Ti bonds inside the Ti(112̅0) surface. The maximum value of the sliding potential energy surface is 1.709 J/m2; the maximum value of the potential energy curve is 0.445 J/m2; and the ideal shear strength of the C(111)/Ti(112̅0) interface is 0.386 GPa. In summary, the interfacial adhesion property of the 2nd-C(111)/Ti(112̅0) interface is better than those of 1st-C(111)/Ti(112̅0) and 4th-C(111)/Ti(112̅0) interfaces.

3.
Langmuir ; 37(48): 14072-14080, 2021 Dec 07.
Article in English | MEDLINE | ID: mdl-34823363

ABSTRACT

In this paper, C and Ti were used as the deposition atoms in the molecular dynamics model. The effects of Ti doping percentages (2, 8, 14, and 20 atom %) on the structure and internal stress of a-C films were investigated. The results showed that with the increase in the Ti percentage, the density of the intrinsic zone is gradually increased, while the growth rate is slowly decreased. The internal stress is gradually changed from compressive stress to tensile stress. Among them, when the Ti percentage is 14 atom %, the internal stress is closer to 0. The C percentage with sp3 hybridization is decreased, while those with sp2 and sp hybridizations are increased. The positions of the first and second peaks in the RDF were shifted to the left. Moreover, the distribution of bond lengths and bond angles in the intrinsic zone tend to change from diamond to graphite, which proves that Ti doping leads to the graphitization of a-C films. In addition, Ti doping affects the internal stress of a-C films by changing the C percentage with sp3 hybridization in them.

4.
Comput Biol Med ; 75: 1-9, 2016 08 01.
Article in English | MEDLINE | ID: mdl-27213920

ABSTRACT

Facial soft tissue deformation following osteotomy is associated with the corresponding biomechanical characteristics of bone and soft tissues. However, none of the methods devised to predict soft tissue deformation after osteotomy incorporates population-based statistical data. The aim of this study is to establish a statistical model to describe the relationship between biomechanical characteristics and soft tissue deformation after osteotomy. We proposed an incremental kernel ridge regression (IKRR) model to accomplish this goal. The input of the model is the biomechanical information computed by the Finite Element Method (FEM). The output is the soft tissue deformation generated from the paired pre-operative and post-operative 3D images. The model is adjusted incrementally with each new patient's biomechanical information. Therefore, the IKRR model enables us to predict potential soft tissue deformations for new patient by using both biomechanical and statistical information. The integration of these two types of data is critically important for accurate simulations of soft-tissue changes after surgery. The proposed method was evaluated by leave-one-out cross-validation using data from 11 patients. The average prediction error of our model (0.9103mm) was lower than some state-of-the-art algorithms. This model is promising as a reliable way to prevent the risk of facial distortion after craniomaxillofacial surgery.


Subject(s)
Face/pathology , Face/surgery , Models, Biological , Osteotomy , Computer Simulation , Female , Humans , Male
5.
Zhongguo Gu Shang ; 29(1): 94-8, 2016 Jan.
Article in Chinese | MEDLINE | ID: mdl-27019908

ABSTRACT

Metastatic epidural compression of the spinal cord is a significant source of morbidity in patients with systemic cancer. With improvment of oncotheray, survival period in the patients is improving and metastatic cord compression is en- countered increasingly often. Surgical management performed for early circumferential decompression for the spinal cord com- pression with spine instability, and spine reconstruction performed. Patients with radiosensitive tumours without spine instabili- ty, radiotherapy is an effective therapy. Spinal stereotactic radiosurgery and minimally invasive techniques, such as vertebro- plasty and kyphoplasty, percutaneous pedicle screw fixation, radiofrequency ablation are promising options for treatment of cer- tain selected patients with spinal metastases.


Subject(s)
Spinal Cord Compression/therapy , Spinal Neoplasms/secondary , Spinal Neoplasms/therapy , Decompression, Surgical , Humans , Minimally Invasive Surgical Procedures
6.
Mol Cell Biochem ; 392(1-2): 85-93, 2014 Jul.
Article in English | MEDLINE | ID: mdl-24752351

ABSTRACT

Estrogen deficiency is the main reason of bone loss, leading to postmenopausal osteoporosis, and estrogen replacement therapy (ERT) has been demonstrated to protect bone loss efficiently. Notch signaling controls proliferation and differentiation of bone marrow-derived mesenchymal stem cells (BMSCs). Moreover, imperfect estrogen-responsive elements (EREs) were found in the 5'-untranslated region of Notch1 and Jagged1. Thus, we examined the molecular and biological links between estrogen and the Notch signaling in postmenopausal osteoporosis in vitro. hBMSCs were obtained from healthy women and patients with postmenopausal osteoporosis. Notch signaling molecules were quantified using real-time polymerase chain reaction (real-time PCR) and Western Blot. Luciferase reporter constructs with putative EREs were transfected into hBMSCs and analyzed. hBMSCs were transduced with lentiviral vectors containing human Notch1 intracellular domain (NICD1). We also used N-[N-(3, 5-diflurophenylacetate)-l-alanyl]-(S)-phenylglycine t-butyl ester, a γ-secretase inhibitor, to suppress the Notch signaling. We found that estrogen enhanced the Notch signaling in hBMSCs by promoting the expression of Jagged1. hBMSCs cultured with estrogen resulted in the up-regulation of Notch signaling and increased proliferation and differentiation. Enhanced Notch signaling could enhance the proliferation and differentiation of hBMSCs from patients with postmenopausal osteoporosis (OP-hBMSCs). Our results demonstrated that estrogen preserved bone mass partly by activating the Notch signaling. Because long-term ERT has been associated with several side effects, the Notch signaling could be a potential target for treating postmenopausal osteoporosis.


Subject(s)
Cell Differentiation/drug effects , Cell Proliferation/drug effects , Estrogens/pharmacology , Mesenchymal Stem Cells/drug effects , Osteoporosis, Postmenopausal/pathology , Receptors, Notch/metabolism , Adult , Case-Control Studies , Cells, Cultured , Female , Humans , Mesenchymal Stem Cells/cytology , Middle Aged , Signal Transduction
7.
Eur J Pharmacol ; 689(1-3): 31-7, 2012 Aug 15.
Article in English | MEDLINE | ID: mdl-22683865

ABSTRACT

Oxidative stress can induce apoptosis and decrease activities of osteoblasts. 2,3,5,4'-tetrahydroxystilbene-2-O-ß-D-glucoside (TSG), is a potent antioxidant derived from a Chinese herb Polygonum multiflorum Thunb. To evaluate the protective effect provided by TSG to osteoblastic MC3T3-E1 cells, the cells were pretreated with TSG for 24h before being treated with 0.3mM hydrogen peroxide (H(2)O(2)) for 24 h, then some markers of osteoblast function and oxidative damage of the cells were examined. Our data demonstrated that TSG significantly (P< 0.05) increased cell survival, alkaline phosphatase (ALP) activity, calcium deposition, and the mRNA expression of ALP, collagen I (COL-I) and osteocalcin (OCN) in the presence of H(2)O(2). In addition, TSG decreased the production of receptor activator of nuclear factor-κB ligand (RANKL), interleukin-6 (IL-6), intracellular reactive oxygen species and malondialdehyde (MDA) of osteoblastic MC3T3-E1 cells induced by H(2)O(2). Taken together, these results demonstrated that the protective effect provided by TSG to osteoblastic MC3T3-E1 cells was mediated, at least in part, via inhibition of the release of bone-resorbing mediators and oxidative damage of the cells. Our results indicated that TSG may be effective in providing protection against osteoporosis associated with oxidative stress.


Subject(s)
Cytoprotection/drug effects , Glucosides/pharmacology , Hydrogen Peroxide/toxicity , Osteoblasts/drug effects , Oxidative Stress/drug effects , Stilbenes/pharmacology , 3T3 Cells , Animals , Cell Survival/drug effects , Cell Survival/physiology , Cytoprotection/physiology , Mice , Osteoblasts/metabolism , Oxidative Stress/physiology
8.
Med Image Comput Comput Assist Interv ; 15(Pt 1): 99-106, 2012.
Article in English | MEDLINE | ID: mdl-23285540

ABSTRACT

This paper proposes a nonlinear regression model to predict soft tissue deformation after maxillofacial surgery. The feature which served as input in the model is extracted with finite element model (FEM). The output in the model is the facial deformation calculated from the preoperative and postoperative 3D data. After finding the relevance between feature and facial deformation by using the regression model, we establish a general relationship which can be applied to all the patients. As a new patient comes, we predict his/her facial deformation by combining the general relationship and the new patient's biomechanical properties. Thus, our model is biomechanical relevant and statistical relevant. Validation on eleven patients demonstrates the effectiveness and efficiency of our method.


Subject(s)
Face/surgery , Surgery, Computer-Assisted/methods , Surgery, Oral/methods , Algorithms , Biomechanical Phenomena , Diagnostic Imaging/methods , Face/pathology , Female , Finite Element Analysis , Humans , Imaging, Three-Dimensional , Models, Statistical , Radiographic Image Interpretation, Computer-Assisted , Regression Analysis , Tomography, X-Ray Computed/methods , Visible Human Projects
9.
Spine J ; 11(4): 281-9, 2011 Apr.
Article in English | MEDLINE | ID: mdl-21377939

ABSTRACT

BACKGROUND CONTEXT: Although anterior cervical decompression and fusion has been used successfully in the treatment of symptomatic radiculopathy and/or myelopathy, biomechanical studies have suggested possible deleterious effects of cervical fusion on adjacent level kinematics. The emergence of cervical arthroplasty as an alternative to arthrodesis may restore a more normal spinal movement and reduces a kinematic strain on adjacent segments. To date, with existing prostheses, the risk adjacent segment disease has not been proven to be reduced using artificial disc replacement. PURPOSE: The study was designed to investigate the surgical techniques and clinical effects of the Discover artificial cervical disc prosthesis in a Chinese population and observe the stability and range of movement in the early and immediate postoperative period. STUDY DESIGN/SETTING: Our clinical study design was prospective, concurrently enrolled, and single-center trial of the artificial cervical disc prosthesis (DePuy Spine, Raynham, MA, USA) in the treatment of patients with single- and two-level degenerative disc disease of the cervical spine. PATIENT SAMPLE: Procedure was performed in 25 patients. OUTCOME MEASURES: The functional spinal unit (FSU) and global angles, segmental and overall range of motion, FSU heights, and clinical parameters checked with Neck Disability Index (NDI), Japanese Orthopedic Association (JOA), Odom's scale, and visual analog scale (VAS) pain score were assessed. METHODS: Twenty-five patients (26 discs) consecutively underwent cervical arthroplasty using the Discover artificial cervical disc in our hospital. Clinical and radiologic follow-up was performed. The radiographic parameters evaluated included the treated segments and the overall curvature of the cervical spine. RESULTS: All the patients were assessed between 12 months and 18 months after surgery (average 15.3 months). According to Odom's scale, all 25 patients (26 levels) had good to excellent outcomes by independent assessment. Mean NDI, JOA, and VAS scores showed statistical improvements in the early and immediate postoperative period. The range of movement recovered to the preoperative value during the follow-up. The treated segment ultimately showed preservation of movement when compared with preoperative levels. No prosthesis subsidence or excursion was identified, and no heterotopic ossification was found in the replaced levels. CONCLUSION: These early results from a small cohort demonstrate that cervical arthroplasty with the Discover artificial cervical disc for the treatment of degenerative cervical disc disease may provide a good clinical outcome and preserves some motion postoperatively. Although early outcomes are promising, this is also a relatively new technology and prosthesis, long-term follow-up studies with larger patient numbers are required to assess safety and efficacy compared with alternative treatments.


Subject(s)
Arthroplasty, Replacement/instrumentation , Intervertebral Disc Degeneration/surgery , Joint Prosthesis , Prosthesis Implantation/instrumentation , Adult , Aged , Arthroplasty, Replacement/methods , Biomechanical Phenomena , Cervical Vertebrae , Female , Follow-Up Studies , Humans , Intervertebral Disc/surgery , Male , Middle Aged , Prosthesis Implantation/methods , Range of Motion, Articular/physiology , Treatment Outcome
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