Results 41 to 50 of about 247,330 (265)

Theoretical Calculations for Explosives

Industrial & Engineering Chemistry, 1941
Includes bibliography. ; Mode of access: Internet.
openaire   +2 more sources

Theoretical Calculations on Solid Argon [PDF]

Nature, 1956
IT is well known that a knowledge of the second virial coefficient of a gas does not suffice to specify the intermolecular potential of the constituent molecules. In fact, even if a simple formula of Mie–Lennard-Jones type is used as an approximation to the potential, the parameters are not uniquely determined by the second virial coefficient.
C. DOMB, I. J. ZUCKER
openaire   +1 more source

Ta₃N₅ Nanobelt-Loaded Ru Nanoparticle Hybrids’ Electrocatalysis for Hydrogen Evolution in Alkaline Media

Molecules, 2023
Electrochemical hydrogen evolution is a highly efficient way to produce hydrogen, but since it is limited by high-cost electrocatalysts, the preparation of high-efficiency electrocatalysts with fewer or free noble metals is important.
Xinyu Zhang, Lulu Xu, Xingcai Wu, Yourong Tao, Weiwei Xiong   +4 more
doaj   +1 more source

Network divergence analysis identifies adaptive gene modules and two orthogonal vulnerability axes in pancreatic cancer

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, Lyanne Delgado‐Coka, Natalia Marchenko, Luisa F. Escobar‐Hoyos, Kenneth R. Shroyer, Alisa Yurovsky, Trey Ideker, Gábor Balázsi, Thomas MacCarthy, Scott Powers   +9 more
wiley   +1 more source

Cyclohexane Vibronic States: A Combined VUV Spectroscopy and Theoretical Study

Molecules
In this work, we provide results from a joint experimental and theoretical study of the vibronic features of cyclohexane (C6H12) in the photon energy range of 6.8–10.8 eV (182–115 nm).
Edvaldo Bandeira, Alessandra S. Barbosa, Nykola C. Jones, Søren V. Hoffmann, Márcio H. F. Bettega, Paulo Limão-Vieira   +5 more
doaj   +1 more source

Cell‐cycle‐specific lesion evolution rather than inhibition of double‐strand‐break repair underpins cisplatin radiosensitization

Molecular Oncology, EarlyView.
We analyze cisplatin–DNA adducts (CDAs) and double‐strand breaks (DSBs) in a cell‐cycle‐dependent manner. We find that CDAs form similarly across all cell cycle phases. DSBs arise only in S‐phase. CDAs might not directly impair DSB repair, but S‐phase DSB lesions evolve in the presence of CDAs and disrupt repair in G2, also causing radiosensitization ...
Ye Qiu, Xixi Lin, Emil Mladenov, Veronika Mladenova, Jürgen Thomale, Ali Sak, Yao Wang, Yunxuan Deng, Eleni Gkika, Martin Stuschke, George Iliakis   +10 more
wiley   +1 more source

A multi-functional chemosensor for highly selective ratiometric fluorescent detection of silver(I) ion and dual turn-on fluorescent and colorimetric detection of sulfide [PDF]

Royal Society Open Science, 2018
A multi-functional chemosensor 1 as silver and sulfide detector was synthesized by the combination of octopamine and 4-dimethylaminocinnamaldehyde. Sensor 1 exhibited a ratiometric fluorescence emission for Ag+ from blue to sky. The binding mode of 1 and
Ji Hye Kang, Ju Byeong Chae, Cheal Kim   +2 more
doaj   +1 more source

Mycobacterial cell division arrest and smooth‐to‐rough envelope transition using CRISPRi‐mediated genetic repression systems

FEBS Open Bio, EarlyView.
CRISPRI‐mediated gene silencing and phenotypic exploration in nontuberculous mycobacteria. In this Research Protocol, we describe approaches to control, monitor, and quantitatively assess CRISPRI‐mediated gene silencing in M. smegmatis and M. abscessus model organisms.
Vanessa Point, Wafaa Achache, Janïs Laudouze, Eliana Sepulveda Ramos, Mickaël Maziero, Céline Crauste, Stéphane Canaan, Pierre Santucci   +7 more
wiley   +1 more source

Thermodynamics and polarity-driven properties of fluorinated cyclopropanes

Beilstein Journal of Organic Chemistry
Cyclopropane is a significant alicyclic motif, widely utilized in medicinal chemistry, while fluorination serves as a powerful tool to modulate properties that enhance the performance of pharmaceuticals and materials. This quantum-chemical study explores
Matheus P. Freitas
doaj   +1 more source

Crystal structure of N,N′-didecylpyromellitic diimide

Acta Crystallographica Section E: Crystallographic Communications, 2017
The title compound, C30H44N2O4 [systematic name: 2,6-didecylpyrrolo[3,4-f]isoindole-1,3,5,7(2H,6H)-tetraone], consists of a central pyromellitic diimide moiety with terminal decyl groups at the N-atom positions.
Hansu Im, Myong Yong Choi, Cheol Joo Moon, Tae Ho Kim   +3 more
doaj   +1 more source