Ghulam Abbas , S. MuthuMolecular structure solvent–solute, electronic, topology and dynamics simulation studies on 2-[[1-(cyclopropyl methoxy)-4-hydroxy-2-oxoquinoline-3-carbonyl] amino] acetic acid- an effective CKD drugJournal of Molecular Liquids(2023) doi:10.1016/j.molliq.2023.123251 ...
The 100-year resolution bioclimatic layers now available through the CHELSA-TraCE21k database (https://chelsa-climate.org/chelsa-trace21k/; Karger et al., 2023) allowed us to get a more realistic picture of the distributional dynamics of the focal species, which was key for our demographic in...
We shall see what the role of magnetic fields is in the stability of filamentary clouds in these regions and, with the help of numerical simulation, to find out how viewing angle may affect our interpretation of the physical conditions in molecular clouds. 报告人简介: Pak-Shing Li is a...
The CCCTC-binding factor (CTCF) works together with the cohesin complex to drive the formation of chromatin loops and topologically associating domains, but its role in gene regulation has not been fully defined. Here, we investigated the effects of acut
[1]聽Above steep, wave-induced sand ripples, which occur extensively in shallow sea areas, the momentum transfer and suspended sediment dynamics are domina... A.,G.,Davies,... - 《Journal of Geophysical Research Oceans》 被引量: 102发表: 2005年 Beyond Rokeach's Equality‐Freedom Model: Two...
survival in saline conditions. Plants can adapt saline conditions by maintaining ion homeostasis, activating osmotic stress pathways, modulating phytohormone signaling, regulating cytoskeleton dynamics, and maintaining cell wall integrity. To address ionic toxicity, researchers from diverse disciplines have ...
and then use advanced molecular dynamics methods to understand how the protein folds and what the final configuration/structure for the protein might be. The coordinates of the optimized protein structure (e.g. a PDB file) might then go on to be used in docking calculation, etc. Technical asp...
In this work, we use μμs-range molecular dynamics simulations and machine-learning-based postanalysis to explore the molecular mechanisms associated with the recognition of 8-oxoG by hOGG1 when embedded in a multiple-lesion site with a mismatch in 5′′ or 3′′. We delineate the ...