keyword
https://read.qxmd.com/read/38656235/comparison-study-experimental-and-theoretical-hydrogen-bond-interaction-through-water-donor-acceptor-investigation-and-molecular-docking-study-of-3-3-1-2-phenylenebis-azaneylylidene-bis-methaneylylidene-diphenol
#1
JOURNAL ARTICLE
N Elangovan, Munusamy Thirumavalavan, T Sankar Ganesan, S Sowrirajan, S Chandrasekar, Natarajan Arumugam
The novel Schiff's base (CS6) was synthesized and confirmed by various studies. The B3LYP/cc-pVDZ basis set was used for theoretical study and the results indicated that both the theoretical and experimental studies correlated well. The interaction energy of CS6-water complex calculated by using the local energy decomposition analysis was found to be -7.28 kcal/mol. The TD-TFT method was used for the calculation of electronic absorption spectrum. This study confirmed that the observed wavelength and the simulated wavelength in the electronic spectra were almost similar...
April 24, 2024: Journal of Biomolecular Structure & Dynamics
https://read.qxmd.com/read/38654890/patient-abuse-neglect-and-exploitation-why-physicians-need-to-be-trauma-informed
#2
JOURNAL ARTICLE
Kathleen Franchek-Roa, Aarti Vala, Jennifer Goldman, Adam Dell, Angela P Presson, Kaleb Eppich, Wendy L Hobson
INTRODUCTION: Many people experience trauma, and its cumulative effects throughout the life span can alter health, development, and well-being. Despite this, few publications focusing on interpersonal trauma include a holistic understanding of the nature and widespread exposure of trauma experiences for patients. We developed an educational resource to teach residents about identifying and intervening with patients who experience trauma across the life span using a trauma-informed care (TIC) perspective...
2024: MedEdPORTAL Publications
https://read.qxmd.com/read/38647682/flavonoids-as-potential-kras-inhibitors-dft-molecular-docking-molecular-dynamics-simulation-and-admet-analyses
#3
JOURNAL ARTICLE
Prinsa, Supriyo Saha, Md Zahidul Haque Bulbul, Yasuhiro Ozeki, Mubarak A Alamri, Sarkar M A Kawsar
KRAS mutations linked with cancer. Flavonoids were docked against KRAS G12C and G12D receptors. Abyssinone III, alpha naphthoflavone, beta naphthoflavone, abyssinone I, abyssinone II and beta naphthoflavone, genistin, daidzin showed good docking scores against KRAS G12C and G12D receptors, respectively. The MD simulation data revealed that Rg, RMSD, RMSF, and SASA values were within acceptable limits. Alpha and beta naphthoflavone showed good binding energies with KRAS G12C and G12D receptors. DFT and MEP analysis highlighted the nucleophilic and electrophilic zones of best-docked flavonoids...
April 22, 2024: Journal of Asian Natural Products Research
https://read.qxmd.com/read/38646659/a-domain-oriented-approach-to-characterizing-movement-evoked-pain
#4
JOURNAL ARTICLE
Joshua A Crow, Verlin Joseph, Guanhong Miao, Burel R Goodin, Kimberly T Sibille, Josue Cardoso, Emily J Bartley, Roland Staud, Roger B Fillingim, Staja Q Booker
INTRODUCTION: Movement-evoked pain (MEP) impacts a substantial proportion of US adults living with chronic pain. Evidence suggests that MEP is influenced by numerous biopsychosocial factors and mediated by mechanisms differing from those of spontaneous pain. However, both characteristic and mechanistic knowledge of MEP remain limited, hindering effective diagnosis and treatment. OBJECTIVES: We asked (1) can chronic pain, functional, psychosocial, and behavioral measures be grouped into descriptive domains that characterize MEP? and (2) what relationships exist between biopsychosocial factors across multiple domains of MEP? METHODS: We formed 6 characteristic domains from 46 MEP-related variables in a secondary analysis of data from 178 individuals (aged 45-85 years) with knee pain...
June 2024: Pain Reports
https://read.qxmd.com/read/38645713/climate-change-and-mental-health-an-interactive-educational-session
#5
JOURNAL ARTICLE
Andrea Costin, Daniel Fisher, Bethany Harper, Ramzi W Nahhas, John Sullenbarger
INTRODUCTION: Climate change is the single biggest health threat facing humanity, with direct and indirect impacts on mental health, yet health impacts of climate change remain notably absent from most medical school curricula. We describe a timely interactive educational session on climate change and mental health that was implemented and studied on a medical student clinical psychiatry rotation. METHODS: We developed a 1-hour introductory session on the mental health impacts of climate change and potential solutions...
2024: MedEdPORTAL Publications
https://read.qxmd.com/read/38644479/characterization-of-sips-type-aquaporins-and-their-roles-in-response-to-environmental-cues-in-rice-oryza-sativa-l
#6
JOURNAL ARTICLE
Miao Miao, Ximiao Shi, Xiangzi Zheng, Binghua Wu, Ying Miao
BACKGROUND: Aquaporins (AQPs) facilitate water diffusion across biological membranes and are involved in all phases of growth and development. Small and basic intrinsic proteins (SIPs) belong to the fourth subfamily of the plant AQPs. Although SIPs are widely present in higher plants, reports on SIPs are limited. Rice is one of the major food crops in the world, and water use is an important factor affecting rice growth and development; therefore, this study aimed to provide information relevant to the function and environmental response of the rice SIP gene family...
April 22, 2024: BMC Plant Biology
https://read.qxmd.com/read/38640992/plastic-related-endocrine-disrupting-chemicals-significantly-related-to-the-increased-risk-of-estrogen-dependent-diseases-in-women
#7
JOURNAL ARTICLE
Natasha Chitakwa, Mohammed Alqudaimi, Mazhar Sultan, Di Wu
OBJECTIVE: To evaluate the association between exposure to plastic-related endocrine-disrupting chemicals (EDCs), specifically Bisphenol A (BPA), Phthalates, Cadmium, and Lead, and the risk of estrogen-dependent diseases (EDDs) such as polycystic ovary syndrome (PCOS), endometriosis, or endometrial cancer by conducting a meta-analysis of relevant studies. METHODS: PubMed, Web of Science, and Cochrane Library databases were used for literature retrieval of articles published until the 21st of April, 2023...
April 17, 2024: Environmental Research
https://read.qxmd.com/read/38640331/impact-of-various-anesthetic-regimens-on-motor-evoked-potentials-in-infants-undergoing-spinal-surgery-a-case-series
#8
JOURNAL ARTICLE
Hirofumi Nakahari, Makoto Ikeda, Niall C T Wilton, Michihiro Kurimoto, Taiki Kojima
Motor-evoked potential (MEP) monitoring is commonly used in children. MEP monitoring in infants is difficult due to smaller signals requiring higher stimulation voltages. There is limited information on the effect of different anesthetics on MEP monitoring in this age group. This case series describes the effect of different anesthetic regimens on MEP monitoring in infants. Patients <1 year of age who underwent spinal surgery with MEP monitoring between February 2022 and July 2023 at a single tertiary care children hospital were reviewed...
April 19, 2024: Medicine (Baltimore)
https://read.qxmd.com/read/38640138/relationship-between-phthalates-exposures-and-metabolic-dysfunction-associated-fatty-liver-disease-in-united-states-adults
#9
JOURNAL ARTICLE
Junhao Sun, Siqi Yang, Yue Zhang, Wenzhi Xiang, Xiubo Jiang
As a new definition for the evidence of hepatic steatosis and metabolic dysfunctions, the relationship between phthalates (PAEs) and metabolic dysfunction-associated fatty liver disease (MAFLD) remains virtually unexplored. This study included 3,137 adults from the National Health and Nutrition Examination Survey spanning 2007-2018. The diagnosis of MAFLD depended on the US Fatty Liver Index (US FLI) and evidence of metabolic dysregulation. Eleven metabolites of PAEs were included in the study. Poisson regression, restricted cubic spline (RCS), and weighted quantile sum (WQS) regression were used to assess the associations between phthalate metabolites and MAFLD...
2024: PloS One
https://read.qxmd.com/read/38639454/assessment-of-maximal-inspiratory-and-expiratory-pressures-in-skeletal-class-ii-patients-with-different-growth-patterns
#10
JOURNAL ARTICLE
Hita Rangarajan, Irfan Ismail Ayub, Sridevi Padmanabhan
OBJECTIVES: To evaluate maximal inspiratory (MIP) and expiratory (MEP) pressures, which are reflective of respiratory muscle strength, in skeletal Class II patients with different growth patterns (horizontal, average, and vertical) and to correlate those with airway dimension. MATERIALS AND METHODS: Patients with a Class II skeletal base seeking orthodontic treatment were assigned to the following groups: average, horizontal, and vertical growth pattern. The control group (n = 14) comprised patients with a Class I skeletal base and average growth pattern...
May 1, 2024: Angle Orthodontist
https://read.qxmd.com/read/38634245/traumatic-and-iatrogenic-sciatic-nerve-injury-in-38-dogs-and-10-cats-clinical-and-electrodiagnostic-findings
#11
JOURNAL ARTICLE
Diletta Dell'Apa, Luigi Auletta, Samuel Okonji, Alberto Cauduro, Maurizio Dondi, Mauro Opreni, Gualtiero Gandini, Ezio Bianchi
BACKGROUND: Reports describing sciatic nerve injuries (SNI) and their outcome are scarce in veterinary medicine. HYPOTHESIS: Describe the causes of traumatic and iatrogenic SNI and evaluate which clinical and electrodiagnostic findings predict outcome. ANIMALS: Thirty-eight dogs and 10 cats with confirmed SNI referred for neurologic and electrodiagnostic evaluation. METHODS: Clinical and electrodiagnostic examination results, including electromyography (EMG), motor nerve conduction studies, muscle-evoked potential (MEP), F-waves, sensory nerve conduction studies, and cord dorsum potential (CDP), were retrospectively evaluated...
April 17, 2024: Journal of Veterinary Internal Medicine
https://read.qxmd.com/read/38634228/the-test-retest-reliability-of-non-navigated-transcranial-magnetic-stimulation-tms-measures-of-corticospinal-pathway-excitability-early-after-stroke
#12
JOURNAL ARTICLE
Kathryn C Collins, Allan B Clark, Valerie M Pomeroy, Niamh C Kennedy
PURPOSE: Motor evoked potential (MEP) characteristics are potential biomarkers of whether rehabilitation interventions drive motor recovery after stroke. The test-retest reliability of Transcranial Magnetic Stimulation (TMS) measurements in sub-acute stroke remains unclear. This study aims to determine the test-retest reliability of upper limb MEP measures elicited by non-neuronavigated transcranial magnetic stimulation in sub-acute-stroke. METHODS: In two identical data collection sessions, 1-3 days apart, TMS measures assessed: motor threshold (MT), amplitude, latency (MEP-L), silent period (SP), recruitment curve slope in the biceps brachii (BB), extensor carpi radialis (ECR), and abductor pollicis brevis (APB) muscles of paretic and non-paretic upper limbs...
April 18, 2024: Disability and Rehabilitation
https://read.qxmd.com/read/38632716/accuracy-of-intraoperative-neuromonitoring-in-the-diagnosis-of-intraoperative-neurological-decline-in-the-setting-of-spinal-surgery-a-systematic-review-and-meta-analysis
#13
JOURNAL ARTICLE
Mohammed Ali Alvi, Brian K Kwon, Nader Hejrati, Lindsay A Tetreault, Nathan Evaniew, Andrea C Skelly, Michael G Fehlings
STUDY DESIGN: Systematic review and meta-analysis. OBJECTIVES: In an effort to prevent intraoperative neurological injury during spine surgery, the use of intraoperative neurophysiological monitoring (IONM) has increased significantly in recent years. Using IONM, spinal cord function can be evaluated intraoperatively by recording signals from specific nerve roots, motor tracts, and sensory tracts. We performed a systematic review and meta-analysis of diagnostic test accuracy (DTA) studies to evaluate the efficacy of IONM among patients undergoing spine surgery for any indication...
March 2024: Global Spine Journal
https://read.qxmd.com/read/38632106/using-3d-printing-technology-to-design-split-piece-sleeve-prosthesis-in-the-revision-surgery-of-tumor-type-total-elbow-prosthetic-fractures-a-case-report
#14
Kai Zhai, Kai Zheng, Ming Xu, Zhe-Ming Bao, Zi-Wei Hou, Xiu-Chun Yu
BACKGROUND: Revision of tumor-type prosthetic fractures is very challenging in clinical work. Traditional repair methods may not be able to meet the needs of complex cases or cause greater bone damage. Therefore, more effective and reliable solutions need to be found. CASE PRESENTATION: This study presents a novel revision technique for managing fractures of tumor-type total elbow prostheses. A 57-year-old female patient was diagnosed with a left distal humeral bone tumor accompanied by pathological fracture and underwent customized tumor-type total elbow prosthesis arthroplasty...
April 17, 2024: Orthopaedic Surgery
https://read.qxmd.com/read/38631941/electrophysiological-changes-on-laryngeal-motor-neuropathways-cause-voice-disorders-for-postradiotherapy-patients-with-nasopharyngeal-carcinoma
#15
JOURNAL ARTICLE
Cui He, Libing Guo, Mingfen Zheng, Hong Peng, Xuhui Zhang, Changhe Fan, Xiangdong Zhao, Pinggui Gong, Zeyi Deng, Guang Xu, Cuijie Chen
OBJECTIVE: This study explored electrophysiological changes in the laryngeal motor neuropathway and determined whether lesions in the laryngeal motor cortex (LMC) and its descending tract contribute to voice deterioration and peripheral nerve palsy in patients with nasopharyngeal carcinoma (NPC) postradiotherapy (RT). STUDY DESIGNS: Prospective cohort study. METHODS: Twenty-two patients with NPC at 2 to 4years post-RT (8 female and 14 male), 22 patients with NPC at 8 to 10years post-RT (8 female and 14 male), and 22 healthy individuals (9 female and 13 male) were selected to test their magnetic evoked potentials (MEP), motor nerve conduction, and voice quality using transcranial magnetic stimulation, laryngeal electromyography, and the XION DiVAS acoustic analysis software...
April 16, 2024: Journal of Voice
https://read.qxmd.com/read/38628716/clinical-outcomes-of-olecranon-sled-fixation-in-patients-with-mayo-type-ii-olecranon-fractures
#16
JOURNAL ARTICLE
Chen Chen, Jianyu Zhang, Renwei Cao, Kehan Hua, Yejun Zha, Maoqi Gong, Xieyuan Jiang
BACKGROUND: Tension band wiring and plate fixation are common internal fixation methods used for olecranon fractures, but complications and reoperations are common. The purpose of this study is to investigate the clinical outcomes of displaced olecranon fractures treated with olecranon sled internal fixation. METHODS: The data of 39 patients with olecranon fractures treated with olecranon sled in the Department of Traumatology of Beijing Jishuitan Hospital between May 2018 and April 2020 were retrospectively analyzed...
April 30, 2024: Heliyon
https://read.qxmd.com/read/38628548/an-interactive-mapping-and-case-discussion-seminar-introducing-medical-students-to-climate-change-environmental-justice-and-health
#17
JOURNAL ARTICLE
Victoria Ribeiro, Evan Grossi, Yaxel Levin-Carrion, Novneet Sahu, Michelle DallaPiazza
INTRODUCTION: Integrating climate change and health into a medical school curriculum is critical for future physicians who will manage health crises caused by a rapidly changing climate. Although medical schools have increasingly included climate change in the curriculum, there remains a need to address the link between the climate crisis, environmental justice, and historical policies that shape environmental health disparities in local communities. METHODS: In academic years 2021-2022 (AY22) and 2022-2023 (AY23), second-year medical students participated in a 2...
2024: MedEdPORTAL Publications
https://read.qxmd.com/read/38621645/the-effect-of-transcranial-ultrasound-pulse-repetition-frequency-on-sustained-inhibition-in-the-human-primary-motor-cortex-a-double-blind-sham-controlled-study
#18
JOURNAL ARTICLE
Ali K Zadeh, Hrishikesh Raghuram, Shirshak Shrestha, Mekale Kibreab, Iris Kathol, Davide Martino, G Bruce Pike, Samuel Pichardo, Oury Monchi
BACKGROUND: Non-invasive brain stimulation techniques such as transcranial magnetic stimulation and transcranial direct current stimulation hold promise for inducing brain plasticity. However, their limited precision may hamper certain applications. In contrast, Transcranial Ultrasound Stimulation (TUS), known for its precision and deep brain targeting capabilities, requires further investigation to establish its efficacy in producing enduring effects for treating neurological and psychiatric disorders...
April 13, 2024: Brain Stimulation
https://read.qxmd.com/read/38619970/reliability-of-corticospinal-and-motoneuronal-excitability-evaluation-during-unfatiguing-and-fatiguing-cycling-exercise
#19
JOURNAL ARTICLE
José Mira, Callum G Brownstein, Djahid Kennouche, Giorgio Varesco, Enrico Roma, Thomas Lapole, Guillaume Y Millet
INTRODUCTION: Central nervous system excitability depends on the task performed, muscle group solicited, and contraction type. However, little is known on corticospinal and motoneuronal excitability measured during locomotor exercise. This study aimed at determining the reliability of motor-evoked potentials (MEP) and thoracic motor-evoked potentials (TMEP) in dynamic mode during unfatiguing and fatiguing cycling exercise. METHODS: Twenty-two participants completed four visits...
April 16, 2024: Medicine and Science in Sports and Exercise
https://read.qxmd.com/read/38617684/significant-increase-in-the-dipole-moment-of-graphene-on-functionalization-dft-calculations-and-molecular-dynamics-simulations
#20
JOURNAL ARTICLE
Madhur Babu Singh, Pallavi Jain, Faruq Mohammad, Prashant Singh, Indra Bahadur, Oyirwoth P Abedigamba
The limited solubility of graphene in water can be attributed to the existence of π-π bonds connecting its layers. Functionalized graphene or graphene oxide (GO) is frequently produced in order to overcome the shortcomings of graphene. Using density functional theory (DFT) calculation, functionalized graphene with various combinations of hydroxyl, epoxy, and carboxylic functional groups were investigated computationally. The study focused on the effects of functional group combinations on the highest occupied molecular orbital (HOMO) and lowest unoccupied molecular orbital (LUMO) energies, giving information about the chemical reactivity and stability of the molecules under investigation...
April 9, 2024: ACS Omega
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