keyword
https://read.qxmd.com/read/38686501/non-covalent-planarizing-interactions-yield-highly-ordered-and-thermotropic-liquid-crystalline-conjugated-polymers
#1
JOURNAL ARTICLE
Sina Sabury, Zhuang Xu, Shamil Saiev, Daniel Davies, Anna M Österholm, Joshua M Rinehart, Motahhare Mirhosseini, Benedict Tong, Sanggyun Kim, Juan-Pablo Correa-Baena, Veaceslav Coropceanu, Oana D Jurchescu, Jean-Luc Brédas, Ying Diao, John R Reynolds
Controlling the multi-level assembly and morphological properties of conjugated polymers through structural manipulation has contributed significantly to the advancement of organic electronics. In this work, a redox active conjugated polymer, TPT-TT, composed of alternating 1,4-(2-thienyl)-2,5-dialkoxyphenylene (TPT) and thienothiophene (TT) units is reported with non-covalent intramolecular S⋯O and S⋯H-C interactions that induce controlled main-chain planarity and solid-state order. As confirmed by density functional theory (DFT) calculations, these intramolecular interactions influence the main chain conformation, promoting backbone planarization, while still allowing dihedral rotations at higher kinetic energies (higher temperature), and give rise to temperature-dependent aggregation properties...
April 30, 2024: Materials Horizons
https://read.qxmd.com/read/38672061/in-vivo-total-ankle-arthroplasty-kinematic-evaluation-a-prospective-radiostereometric-analysis
#2
JOURNAL ARTICLE
Silvio Caravelli, Laura Bragonzoni, Raffaele Zinno, Emanuele Vocale, Erika Pinelli, Giuseppe Barone, Giulio Vara, Stefano Di Paolo, Stefano Zaffagnini, Massimiliano Mosca
Ankle osteoarthritis (OA) represents a significant social burden and is one of the main causes of chronic disability in a rapidly growing part of the world's population. Total ankle arthroplasty (TAA) has become increasingly popular despite the poor results obtained with the first dedicated designs. The purpose of this paper was to evaluate the ankle kinematics, in vivo and under weight-bearing conditions, of a TAA through a dynamic model-based radiostereometric analysis (MB-RSA). The clinical evaluation was performed by administering the American Orthopaedic Foot and Ankle Society ankle-hindfoot score and Short Form-36 questionnaires...
March 22, 2024: Biomedicines
https://read.qxmd.com/read/38670656/mechanical-interaction-of-myosin-and-native-thin-filament-in-the-disused-rat-soleus-muscle
#3
JOURNAL ARTICLE
Oksana Gerzen, Iulia Potoskueva, Veronika Votinova, Ksenia Sergeeva, Sergey Tyganov, Alena Tzybina, Boris S Shenkman, Larisa Nikitina
The disuse of skeletal limb muscles occurs in a variety of conditions, yet our comprehension of the molecular mechanisms involved in adaptation to disuse remains incomplete. We studied the mechanical characteristics of actin-myosin interaction using an in vitro motility assay and isoform composition of myosin heavy and light chains by dint of SDS-PAGE in soleus muscle of both control and hindlimb-unloaded rats. 14 days of hindlimb unloading led to the increased maximum sliding velocity of actin, reconstituted, and native thin filaments over rat soleus muscle myosin by 24 %, 19 %, and 20 %, respectively...
May 2024: Life Sciences in Space Research
https://read.qxmd.com/read/38663546/proline-peptide-bond-isomerization-in-ubiquitin-under-folding-and-denaturing-conditions-by-pressure-jump-nmr
#4
JOURNAL ARTICLE
Elahe Masoumzadeh, Jinfa Ying, James L Baber, Philip Anfinrud, Ad Bax
Proline isomerization is widely recognized as a kinetic bottleneck in protein folding, amplified for proteins rich in Pro residues. We introduced repeated hydrostatic pressure jumps between native and pressure-denaturing conditions inside an NMR sample cell to study proline isomerization in the pressure-sensitized L50A ubiquitin mutant. Whereas in two unfolded heptapeptides, X-Pro peptide bonds isomerized ca 1.6-fold faster at 1 bar than at 2.5 kbar, for ubiquitin ca eight-fold faster isomerization was observed for Pro-38 and ca two-fold for Pro-19 and Pro-37 relative to rates measured in the pressure-denatured state...
April 23, 2024: Journal of Molecular Biology
https://read.qxmd.com/read/38661729/hydrothermal-destruction-and-defluorination-of-trifluoroacetic-acid-tfa
#5
JOURNAL ARTICLE
Conrad Austin, Anmol L Purohit, Cody Thomsen, Brian R Pinkard, Timothy J Strathmann, Igor V Novosselov
Per- and polyfluoroalkyl substances (PFAS) have received increased attention due to their environmental prevalence and threat to public health. Trifluoroacetic acid (TFA) is an ultrashort-chain PFAS and the simplest perfluorocarboxylic acid (PFCA). While the US EPA does not currently regulate TFA, its chemical similarity to other PFCAs and its simple molecular structure make it a suitable model compound for studying the transformation of PFAS. We show that hydrothermal processing in compressed liquid water transforms TFA at relatively mild conditions (T = 150-250 °C, P < 30 MPa), initially yielding gaseous products, such as CHF3 and CO2 , that naturally aspirate from the solution...
April 25, 2024: Environmental Science & Technology
https://read.qxmd.com/read/38650841/inter-limb-differences-in-upper-quarter-mobility-stability-are-not-associated-with-performance-in-competitive-swimmers
#6
JOURNAL ARTICLE
Katharina Borgmann, Stefan Panzer, Sam Limpach, Thomas Muehlbauer
BACKGROUND: The Y Balance Test-Upper Quarter (YBT-UQ) is a cost-effective, well-established, closed kinetic chain test to assess inter-limb asymmetries in the upper quarter that could negatively affect swimming performance. Thus, the aim of the present study was to determine YBT-UQ performances and inter-limb differences as well as its association with swimming performance in athletes with diverging levels of expertise. METHODS: Forty female and male competitive swimmers (age range: 10-22 years) with different expertise levels (A-squad: n  = 9, B-squad: n  = 12, C-squad: n  = 19) were tested (reach distances for the YBT-UQ) and swimming performance was calculated using the ratio of individual to world best time...
2024: Frontiers in sports and active living
https://read.qxmd.com/read/38642438/the-associations-of-physical-parameters-with-the-closed-kinetic-chain-upper-extremity-stability-test-the-upper-quarter-y-balance-test-and-the-upper-limb-rotation-test-in-professional-overhead-athletes
#7
JOURNAL ARTICLE
Fırat Kara, Gülbin Ergin Gedik, Ertan Şahinoğlu
OBJECTIVE: To investigate the associations of glenohumeral internal (IR) and external rotation (ER), horizontal adduction (HA), and thoracic spine rotation ranges of motion (ROM), isometric muscle strength of the shoulder rotators, and trunk muscle endurance with the Closed Kinetic Chain Upper Extremity Stability Test (CKCUEST), the Upper Quarter Y Balance Test (YBT-UQ), and the Upper Limb Rotation Test (ULRT) in overhead athletes. DESIGN: Cross-sectional study...
March 18, 2024: Physical Therapy in Sport
https://read.qxmd.com/read/38640285/current-views-on-preoperative-rehabilitation-practice-after-anterior-cruciate-ligament-injury-among-licensed-physical-therapists-in-saudi-arabia-an-online-based-cross-sectional-survey
#8
JOURNAL ARTICLE
Yasir S Alshehri
Preoperative rehabilitation is an important stage to both physically and mentally prepare patients for anterior cruciate ligament reconstruction (ACLR) and postoperative rehabilitation. This study aimed to investigate the current preoperative rehabilitation practice after anterior cruciate ligament injury among licensed physical therapists in Saudi Arabia. This was an online-based cross-sectional survey. A total of 114 physical therapists completed the survey. The survey consisted of 16 mandatory questions about management strategies, prescribed exercises, patients' physical and psychological concerns, and discussions about nonoperative management...
April 19, 2024: Medicine (Baltimore)
https://read.qxmd.com/read/38628437/estimating-3d-kinematics-and-kinetics-from-virtual-inertial-sensor-data-through-musculoskeletal-movement-simulations
#9
JOURNAL ARTICLE
Marlies Nitschke, Eva Dorschky, Sigrid Leyendecker, Bjoern M Eskofier, Anne D Koelewijn
Portable measurement systems using inertial sensors enable motion capture outside the lab, facilitating longitudinal and large-scale studies in natural environments. However, estimating 3D kinematics and kinetics from inertial data for a comprehensive biomechanical movement analysis is still challenging. Machine learning models or stepwise approaches performing Kalman filtering, inverse kinematics, and inverse dynamics can lead to inconsistencies between kinematics and kinetics. We investigated the reconstruction of 3D kinematics and kinetics of arbitrary running motions from inertial sensor data using optimal control simulations of full-body musculoskeletal models...
2024: Frontiers in Bioengineering and Biotechnology
https://read.qxmd.com/read/38594016/the-relationship-of-open-and-closed-kinetic-chain-rate-of-force-development-with-jump-performance-following-anterior-cruciate-ligament-reconstruction
#10
JOURNAL ARTICLE
Megan C Graham, Kelsey A Reeves, Tereza Janatova, Brian Noehren
PURPOSE: To determine between-limbs differences in isometric rate of force development (RFD) measured during open- (OKC) and closed-kinetic-chain (CKC) strength testing and establish which method had the strongest relationship to single-leg vertical-jump performance and knee mechanics after anterior cruciate ligament (ACL) reconstruction. METHODS: Subjects (n = 19) 1 to 5 years from ACL reconstruction performed isometric knee extensions (OKC), unilateral isometric midthigh pulls (CKC), and single-leg vertical jumps on the ACL-involved and -noninvolved limbs...
April 9, 2024: International Journal of Sports Physiology and Performance
https://read.qxmd.com/read/38541838/effects-of-telerehabilitation-combining-diaphragmatic-breathing-re-education-and-shoulder-stabilization-exercises-on-neck-pain-posture-and-function-in-young-adult-men-with-upper-crossed-syndrome-a-randomized-controlled-trial
#11
JOURNAL ARTICLE
Gyeong-Hyeon Jeong, Byoung-Hee Lee
Background: Forward head posture and rounded shoulder posture are common postural variants found in upper crossed syndrome, which can lead to limited neck mobility, respiratory problems, and other issues. The purpose of this study was to investigate the effects of telerehabilitation, combining diaphragmatic breathing re-education and shoulder stabilization exercises, on young men with upper crossed syndrome during the COVID-19 pandemic over 4 weeks. Methods: The study included 37 participants aged in their 20s and 30s who were randomly divided into two groups...
March 11, 2024: Journal of Clinical Medicine
https://read.qxmd.com/read/38533585/the-effects-of-shoulder-stabilization-exercises-on-muscle-strength-proprioceptive-sensory-ability-and-performance-in-office-workers-with-shoulder-protraction
#12
JOURNAL ARTICLE
O Depreli, Z Erden
Objectives . Shoulder protraction is frequently seen in office workers because of working with excessive trunk flexion for a long time. This study aimed to compare the effectiveness of stabilization exercises (SE) given in addition to office exercises (OE). Methods . Sixty office workers with shoulder protraction were divided into SE + OE ( n =  30) and OE ( n =  30) groups by stratified random sampling for 8 weeks and followed up for 4 weeks. Shoulder protraction was assessed with a caliper, muscle strength with a hand-held dynamometer, proprioception with an isokinetic dynamometer, vibration sense with a vibrometer and upper extremity functional performance with the closed kinetic chain upper extremity stability test...
March 27, 2024: International Journal of Occupational Safety and Ergonomics: JOSE
https://read.qxmd.com/read/38493981/characterizing-the-risk-related-to-the-exposure-to-methylmercury-over-a-lifetime-a-global-approach-using-population-internal-exposure
#13
JOURNAL ARTICLE
Thomas Gastellu, Anna Mondou, Marie Bellouard, Jean-Claude Alvarez, Bruno Le Bizec, Gilles Rivière
Seafood products accumulate methylmercury throughout the food chain and are the main source of methylmercury exposure. Methylmercury may trigger a number of adverse health effects, such as neurodevelopmental or nephrotoxic effects, the risk of which cannot be ruled out for the French high consumers of seafood. The characterisation of methylmercury-related risks is generally based on short-term dietary exposure without considering changes in consumption and exposure over the lifetime. Additionally, focusing on short-term dietary exposure, the fate of methylmercury (especially its accumulation) in the organism is not considered...
March 15, 2024: Food and Chemical Toxicology
https://read.qxmd.com/read/38479601/analysis-of-pressure-activated-piezo1-open-and-subconductance-states-at-a-single-channel-level
#14
JOURNAL ARTICLE
Ghanim Ullah, Elena D Nosyreva, David Thompson, Victoria Cuello, Luis G Cuello, Ruhma Syeda
Mechanically activated Piezo1 channels undergo transitions from closed to open-state in response to pressure and other mechanical stimuli. However, the molecular details of these mechanosensitive gating transitions are unknown. Here, we used cell-attached pressure-clamp recordings to acquire single channel data at steady-state conditions (where inactivation has settled down), at various pressures and voltages. Importantly, we identify and analyze subconductance states of the channel which were not reported before...
March 11, 2024: Journal of Biological Chemistry
https://read.qxmd.com/read/38435680/quantitative-model-of-multiple-crystal-growth-rate-minima-in-polymers-with-regularly-spaced-substituent-groups
#15
JOURNAL ARTICLE
Kutlwano Gabana, Gillian A Gehring, Xiangbing Zeng, Goran Ungar
A simple theory has been developed to explain quantitatively the multiple crystal growth rate minima observed experimentally in polyethylene brassylates (PEBs), polymers with regularly spaced "chemical defects", in this case, diester groups separated by 11 methylenes. The minima occur at the transitions where the fold length drops from 4 to 3 repeat units and from 3 to 2 units. An analytical rate-equation model was developed with elementary attachment and detachment steps of individual monomer repeat units, also including postattachment stem lengthening (stem conversion)...
February 27, 2024: Macromolecules
https://read.qxmd.com/read/38421040/assessing-the-role-of-residue-phe108-of-cytochrome-p450-3a4-in-allosteric-effects-of-midazolam-metabolism
#16
JOURNAL ARTICLE
Tingting Fu, Hongxing Zhang, Qingchuan Zheng
Cytochrome P450 3A4 (CYP3A4) is involved in the metabolism of more drugs in clinical use than any other xenobiotic-metabolizing enzyme. CYP3A4-mediated drug metabolism is usually allosterically modulated by substrate concentration (homotropic allostery) and other drugs (heterotropic allostery), exhibiting unusual kinetic profiles and regiospecific metabolism. Recent studies suggest that residue Phe108 (F108) of CYP3A4 may have an important role in drug metabolism. In this work, residue mutations were coupled with well-tempered metadynamics simulations to assess the importance of F108 in the allosteric effects of midazolam metabolism...
February 29, 2024: Physical Chemistry Chemical Physics: PCCP
https://read.qxmd.com/read/38398339/relationship-between-upper-limb-functional-assessment-and-clinical-tests-of-shoulder-mobility-and-posture-in-individuals-participating-in-recreational-strength-training
#17
JOURNAL ARTICLE
Magdalena Zawadka, Marta Gaweł, Agnieszka Tomczyk-Warunek, Karolina Turżańska, Tomasz Blicharski
BACKGROUND: The upper limb is crucial for functioning in everyday life, thus comprehensive assessment is crucial for physically active people to monitor the effect of exercise and prevent injuries. The aim of this study was to analyse the relationship between upper limb function, shoulder mobility, and posture in individuals who participate in recreational strength training. METHODS: Thirty-four subjects who engaged in strength training of the upper limbs were divided into two groups: Group 1 (exercise < 3 years) and Group 2 (exercise ≥ 3 years)...
February 10, 2024: Journal of Clinical Medicine
https://read.qxmd.com/read/38335650/intrinsic-graft-laxity-variation-with-open-kinetic-chain-exercise-after-anterior-cruciate-ligament-reconstruction-a-non-randomized-controlled-study
#18
JOURNAL ARTICLE
Florian Forelli, Jean Mazeas, Yannis Zeghoudi, Amaury Vandebrouck, Pascal Duffiet, Louis Ratte, Georgios Kakavas, Timothy E Hewett, Vasileios Korakakis, Alexandre J M Rambaud
OBJECTIVES: To determine whether quadriceps and hamstring strengthening in a rehabilitation program involving early open kinetic chain (OKC) and/or closed kinetic chain (CKC) knee joint exercises had an influence on graft laxity at 1, 3, and 6 months after anterior cruciate ligament reconstruction (ACLR). DESIGN: Retrospective study. METHODS: Two groups (n = 53) of ACLR patients (combination of OKC and CKC exercises group compared to a CKC exercise group) were recruited...
March 2024: Physical Therapy in Sport
https://read.qxmd.com/read/38313664/the-closed-kinetic-chain-upper-extremity-stability-test-ckcuest-performance-in-elite-team-handball-players-playing-with-shoulder-pain-previous-pain-or-no-pain
#19
JOURNAL ARTICLE
Tina Piil Torabi, Jesper Bencke, Roland van den Tillaar
BACKGROUND: Physical therapists use tests that could determine strength and weaknesses of the shoulder for overhead throwing athletes to enhance performance, prevent injury, and safely progress rehabilitation. The Closed Kinetic Chain Upper Extremity Stability Test (CKCUEST) has been proposed to assess muscular capacity and dynamic shoulder stability in overhead athletes, which could provide information to determine a risk of injury. PURPOSE: To investigate if the CKCUEST is an appropriate test to implement within team elite handball players to evaluate dynamic shoulder stability across sexes and in the screening of shoulder pain...
2024: International Journal of Sports Physical Therapy
https://read.qxmd.com/read/38307332/benzopyrene-elimination-from-the-environment-using-graphitic-carbon-nitride-sns-nanocomposites
#20
JOURNAL ARTICLE
Devaraj Bharathi, Jintae Lee, Yamini Vinayagam, Manosi Banerjee, Gnanasambandan Ramanathan, Mysoon M Al-Ansari, Ganesh Venkatraman, Devi Rajeswari V
Benzopyrene (BaP) stands as a potent polycyclic aromatic hydrocarbon (PAH) molecule, boasting five fused aromatic rings, making its way into the human food chain through soil contamination. The persistent environmental presence of PAHs in soil, attributed to industrial exposure, is primarily due to their low molecular weight and hydrophobic nature. To preemptively address the entry of BaP into the food chain, the application of nanocomposites was identified as an effective remediation strategy. Post-synthesis, comprehensive characterization tests employing techniques such as UV-DRS, XRD, SEM-EDX, FTIR, and DLS unveiled the distinctive features of the g-C3 N4 -SnS nanocomposites...
January 31, 2024: Chemosphere
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