Results 11 to 20 of about 26,491 (188)

Deciphering Ball Milling Mechanochemistry via Molecular Simulations of Collision-Driven and Liquid-Assisted Reactivity. [PDF]

Angew Chem Int Ed Engl
Supported by experiments, molecular dynamics simulations were developed to reveal how mechanochemical reactions, such as between KCl and 18‐crown‐6 with water as a liquid additive, proceed. Product formation is triggered by collision‐induced fragmentation, with liquid content showing a non‐linear effect.
Gayen R, Vugrin L, Zhang Z, Hantal G, Halasz I, Smith AS.   +5 more
europepmc   +3 more sources

Biopsychosocial predictors of rapid weight gain from birth to 6 months. [PDF]

Pediatr Obes
Summary Background Childhood obesity remains a public health crisis and identification of unique prenatal and early infancy predictors of obesity risk are critically needed. Objectives We test a comprehensive biopsychosocial model of the predictors of rapid weight gain (RWG) in the first 6 months of life.
Leerkes EM, Buehler C, Wideman L, Chen Y, Shriver LH.   +4 more
europepmc   +2 more sources

Role of a Croatian National Repository Infrastructure in Promotion and Support of Research Data Management

Data Science Journal, 2020
The paper will give an overview of national infrastructure for digital repositories, Digital Academic Archives and Repositories (DABAR), and its role as technology steward in raising awareness about research data management (RDM) and promoting good ...
Kristina Posavec, Draženko Celjak, Ljiljana Jertec Musap   +2 more
doaj   +1 more source

Pro-oxidant potency of clothianidin in rainbow trout

Arhiv za Higijenu Rada i Toksikologiju, 2021
Clothianidin is a systemic neonicotinoid insecticide interfering with the central nervous system by acting as a nicotinic acetylcholine receptor agonist.
Fakhereddin Tarek, Doğan Demet
doaj   +1 more source

Toxicopathological changes induced by combined exposure to noise and toluene in New Zealand White rabbits

Arhiv za Higijenu Rada i Toksikologiju, 2022
Noise and toluene can have significant adverse effects on different systems in the human body, but little is known about their combination. The aim of this study was to see how their combined action reflects on serum levels of inflammatory cytokines ...
Abouee-Mehrizi Amirreza, Rasoulzadeh Yahya, Kazemi Tohid, Mehdipour Ahmad, Mesgari-Abbasi Mehran   +4 more
doaj   +1 more source

Molecular and Electronic Structure and Properties of the Single Benzene-Based Fluorophores Containing Guanidine Subunit. [PDF]

J Comput Chem
The novel single‐benzene fluorophores (SBFs) containing guanidine subunit were modeled by the TDDFT approach assuming chloroform as the solvent. Emphasis was laid on the influence of the protonation on the changes in basicity in the S1 state and the basic photophysical properties: absorption and emission energies.
Glasovac Z, Margetić D, Antol I.
europepmc   +2 more sources

Allosteric regulation of L-lactate dehydrogenase: Beyond effector-mediated tetramerization. [PDF]

Protein Sci
Abstract The activity of allosterically regulated enzyme is modulated through structural changes induced by effectors. L‐lactate dehydrogenase from Geobacillus stearothermophilus (GsLDH) catalyzes the reversible conversion between pyruvate and lactate using NAD(H), and its activity is known to be activated by fructose 1,6‐bisphosphate (FBP).
Cai H, Shulami S, Štefanić Z, Hrenar T, Maršavelski A, Fishman A.   +5 more
europepmc   +2 more sources

Significant Tumor Inhibition of Trimethyl-15²-[L-aspartyl]pheophorbide a in Tumor Photodynamic Therapy^≠. [PDF]

ChemMedChem
Novel pheophorbide A, a chlorophyll‐derived compound was prepared by simple and sustainable synthesis. Small structural change to known molecules has a profound effect on the PDT efficacy and its phototoxicity is substantially higher than reference compound m‐THPC.
Benić A, Kussayeva A, Antol I, Vazdar M, Brkljača Z, Chen DY, Yan YJ, Gao YH, Chen ZL, Margetić D.   +9 more
europepmc   +2 more sources

Algorithm for Adapting Cases Represented in a Tractable Description Logic [PDF]

, 2014
Case-based reasoning (CBR) based on description logics (DLs) has gained a lot of attention lately. Adaptation is a basic task in the CBR inference that can be modeled as the knowledge base revision problem and solved in propositional logic.
A.A. Sánchez-Ruiz, C.E. Alchourrón, D. Calvanese, E. Kharlamov, F. Baader, H. Katsuno, I. Horrocks, I. Horrocks, J. Cojan, J. Lieber, K. Lehmann, M. d’Aquin, M. Gómez-Albarrán, T.G.O. Consortium   +13 more
core   +1 more source

Schémas régionaux de cohérence écologique : les questionnements, les méthodes d’identification utilisées, les lacunes [PDF]

, 2014
Après avoir rappelé le contexte et les objectifs de la trame verte et bleue, sa mise en ½uvre est rapidement décrite dans ses trois niveaux spatiaux (national, régional et local).
Amsallem, J., Vanpeene Bruhier, S.
core   +2 more sources