Results 81 to 90 of about 173,810 (326)

QSAR-Driven Discovery of Novel Chemical Scaffolds Active against Schistosoma mansoni. [PDF]

, 2016
Schistosomiasis is a neglected tropical disease that affects millions of people worldwide. Thioredoxin glutathione reductase of Schistosoma mansoni (SmTGR) is a validated drug target that plays a crucial role in the redox homeostasis of the parasite.
Anne E. Carpenter, Bruno J. Neves, Carolina H. Andrade, Cleber C. Melo-Filho, Eugene N. Muratov, Floriano P. Silva-Junior, João M. Rezende-Neto, Kroemer R. T., Lee Kamentsky, Lowis D. R., Mario R. Senger, Nicholas Furnham, Rafael F. Dantas, Rodolpho C. Braga, Ross A. Paveley, Walter C. G. Valente, Willian T. Chaves   +16 more
core   +3 more sources

Molecular Simulation of Functionalized Covalent Organic Framework Membranes for Inorganic Salt Separation

Advanced Theory and Simulations, EarlyView.
Six functionalized TpPa‐based covalent organic frameworks (COFs) are characterized using nonequilibrium molecular dynamics simulations to assess water permeance and salt rejection. The TpPa‐SO3H COF membrane achieves the highest sodium sulfate rejection (>98%) while maintaining relatively high water permeance compared to commercial nanofiltration ...
Grace Wei, Anand Narayanan Krishnamoorthy, Ganesh Sivaraman, Lauren Valentino   +3 more
wiley   +1 more source

Selective Response of Mesoporous Silicon to Adsorbants with Nitro Groups

, 2012
We demonstrate that the electronic structure of mesoporous silicon is affected by adsorption of nitro-based explosive molecules in a compound-selective manner. This selective response is demonstrated by probing the adsorption of two nitro-based molecular
Allen, Baratto, Barla, Becke, Bemm, Bisi, Bjorklund, Blöchl, Boarino, Boese, Buczko, Buriak, Buriak, Cella, Chen, Chun, Cullis, De Stefano, DiStefano, Dubbeldam, Ewing, Gavartin, Gindulytè, Harper, Hu, Jarvis, Jia, Kao, Kao, Kim, Kim, Kimmel, Kimmel, Ko, Kolobov, Kresse, Kuklja, Kuklja, Kurmaev, Lauerhaas, Lauerhaas, Lee, Levitsky, Lin, Lin, Létant, Maley, Mawhinney, Mizsei, Mulloni, Naddo, Narayanan, Ogasawara, Pacholski, Pancheri, Pancheri, Pap, Perdew, Politzer, Pushkarsky, Regier, Rose, Rotaru, Saarinen, Sanchez, Scopel, Sharov, Snow, Song, Song, Steinfeld, Sushko, Sweryda-Krawiec, Tanaka, Theiß, Timoshenko, Valiullin, Vourvopoulos, Wang, Xu, Yang, Yang, Yinon, Zerilli, Zhou   +84 more
core   +1 more source

Targeting Adipose Tissue Function Protects Against Heart Failure with Preserved Ejection Fraction

Advanced Science, EarlyView.
This study explores the role adipose tissue (AT) phenotypes have in determining cardiovascular outcomes in an obesity‐related heart failure with preserved ejection fraction (HFpEF) model. Pharmacological induction of thermogenesis promoted resilience to HFpEF‐induced remodeling of AT and conferred cardioprotection. Surgical and genetic models confirmed
Jordan Jousma, Zhenbo Han, Jooman Park, Gege Yan, Sen Zhang, Youjeong Kwon, Sarath Babu Nukala, Jindpreet Kandola, Sandra Pinho, Chong Wee Liew, Yuwei Jiang, Sang‐Ging Ong   +11 more
wiley   +1 more source

Atmospheric Research and Monitoring Study of Hazardous Substances [PDF]

, 1985
Hazardous Waste Research and Information Center Illinois Department of Energy and Natural ...
Gatz, Donald F., Sweet, Clyde W.
core  

Regulation of Excitonic Behavior in Defective Acetylenic Polymers Enables Mechanism Switching in O2 Activation for Enhanced Water Decontamination

Advanced Science, EarlyView.
A molecular defect‐mediated charge accumulation strategy is developed to regulate the exciton behavior for selective molecular oxygen (O2)activation in poly(1,3,5‐triethynylbenzene) (PTEB). Artificial internal electric field (IEF) constructed in defective PTEB provides internal driving force to steer the directed migration of charge carriers, thereby ...
Xiaofeng Tang, Sijia Jin, Wei Li, Yingrong Wang, Haiyan Zhang, Zhiqiao He, Shuang Song, Yaqi Cai, Tao Zeng   +8 more
wiley   +1 more source

10-Formyl-2,4,6,8,12-pentanitro-2,4,6,8,10,12-hexaazatetracyclo[5.5.0.03,11.05,9]dodecane

Acta Crystallographica Section E, 2009
The title compound, C7H7N11O11 (PNMFIW), is a caged heterocycle substituted with five nitro and one formyl groups. It is related to the hexaazaisowurtzitane family of high-density high-energy polycyclic cage compounds.
Yanshan Shi, Lijie Li, Huaxiong Chen, Shusen Chen, Shaohua Jin   +4 more
doaj   +1 more source

Phosphorus-containing imide resins [PDF]

, 1983
Bis- and tris-imides derived from tris (m-aminophenyl) phosphine oxides by reaction with maleic anhydride or its derivatives, and addition polymers of such imides, including a variant in which a mono-imide is condensed with a dianhydride and the product ...
Fohlen, G. M., Parker, J. A., Varma, I. K.   +2 more
core   +1 more source

Rigid Hollow Microparticles for Enhanced Focused Ultrasound Treatment Under Optoacoustic Guidance

Advanced Science, EarlyView.
By combining focused ultrasound (FUS) and acoustically active hollow borosilicate microparticles (HBMPs), we demonstrate tunable control over interparticle dynamics and their localized thermal energy deposition. Modulation of acoustic frequency and particle concentration tailors the energy delivery, allowing adaptive, material‐based regulation of ...
Nima Mahkam, Yi Chen, Héctor Estrada, Ananya Amitabh, Amirreza Aghakhani, Metin Sitti, Daniel Razansky   +6 more
wiley   +1 more source

Theoretical Study on the Conformational Equilibrium of 1’, 2' and 3'-Nitro-4-hydroxy-3-methoxy Chalcone Isomers

Orbital: The Electronic Journal of Chemistry, 2021
This paper presents the conformational analysis of three chalcone compounds, 1'-nitro-4-hydroxy-3-metoxychalcoea (o-CHAL), 2'-nitro-4-hydroxy-3-metoxychalcone (m-CHAL) and 3'-nitro-4-hydroxiy3-metoxychalcone (p-CHAL).
Hualace Vinicius Emiliano, Raphaela Pereira Guaringue, Thiago de Castro Rozada, Barbara Celânia Fiorin   +3 more
doaj