Results 51 to 60 of about 254,848 (264)
Phosphoinositides and inositol phosphates as molecular glues
FEBS Letters, EarlyView.Inositol phosphates (IPs) and phosphoinositides (PIPs) regulate diverse eukaryotic processes. Beyond recruiting signaling proteins or acting as structural cofactors, recent studies suggest they mediate protein–protein interactions as natural molecular glues.
Aleshia Seaton‐Terry +9 more
wiley +1 more source
Study on wetting effect of multi-component surfactant compounding on bituminous coal
Meikuang AnquanSurfactant is a substance that is soluble in water and can significantly reduce the surface tension of the solution, which can effectively solve the problem of dust hazards in the underground mining work of coal mines.
Jingyan JIN +5 more
doaj +1 more source
Electrostatic Embedding of Machine Learning Potentials
Journal of Chemical Theory and Computation, 2022 This work presents a variant of an electrostatic embedding scheme that allows the embedding of arbitrary machine learned potentials trained on molecular systems in vacuo. The scheme is based on physically motivated models of electronic density and polarizability, resulting in a generic model without relying on an exhaustive training set.
openaire +3 more sources
Structural insights and therapeutic targets in Acinetobacter baumannii capsule biosynthesis
FEBS Letters, EarlyView.Hypervirulent KL49 A. baumannii's capsular polysaccharide contains the nonulosonic acid 8‐epi‐Leg5,7Ac2, synthesized by epimerization via ElaA, ElaB, and ElaC. Crystal structures of ElaA, ElaB, and ElaC reveal their role in CMP‐Leg5,7Ac2 synthesis and regioselective C8 epimerization.
Woo Cheol Lee +7 more
wiley +1 more source
Molecular Oncology, EarlyView.Aptamers are used both therapeutically and as targeting agents in cancer treatment. We developed an aptamer‐targeted PLGA–TRAIL nanosystem that exhibited superior therapeutic efficacy in NOD/SCID breast cancer models. This nanosystem represents a novel biotechnological drug candidate for suppressing resistance development in breast cancer.
Gulen Melike Demirbolat +8 more
wiley +1 more source
Crystal Structure Prediction and Intermolecular Interaction Study of CL-20/NQ Cocrystal Explosive
四川大学学报. 自然科学版, 2016 Density functional theory was employed to investigate the four structures (a, b, c, d) of CL-20/NQ cocrystal. The intermolecular interaction, explosive property, and crystal structure were analyzed and predicted in this paper.
GOU Rui-Jun +5 more
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Engineering a genetically-encoded SHG chromophore by electrostatic targeting to the membrane
Frontiers in Molecular Neuroscience, 2014 Although second harmonic generation (SHG) microscopy provides unique imaging advantages for voltage imaging and other biological applications, genetically-encoded SHG chromophores remain relatively unexplored.
Yuka eJinno +7 more
doaj +1 more source
Counting Equilibria of the Electrostatic Potential
CoRRThis new version contains a further major development, a new improved upper bound on the number of equilibria to the electrostatic ...
Herbert Edelsbrunner +2 more
openaire +2 more sources
Molecular Oncology, EarlyView.Tumors contain diverse cellular states whose behavior is shaped by context‐dependent gene coordination. By comparing gene–gene relationships across biological contexts, we identify adaptive transcriptional modules that reorganize into distinct vulnerability axes.
Brian Nelson +9 more
wiley +1 more source
Вестник Северо-Кавказского федерального университета, 2022 The article presents the results of quantum-chemical study of influence of electrochemically activated water on the catalytic activity of proteolytic enzyme subtilisin, producer - Bacillus licheniformis.
Aleksandr Borisenko +3 more
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