Results 41 to 50 of about 4,301,858 (301)

Bis(15-crown-5-κ5O)barium tetrakis(isothiocynato-κN)zinc(II)

IUCrData, 2019
In the title compound, [Ba(C10H20O5)2][Zn(NCS)4], the 15-crown-5 molecules are disordered over two positions with site occupancies of 0.706 (4) and 0.294 (4).
V. Ramesh, K. Rajarajan, B. Gunasekaran
doaj   +1 more source

The Quantum Electronic Partitioning as Modernization in the Studies of the Intermolecular Interactions

Orbital: The Electronic Journal of Chemistry, 2022
Throughout the years, the evolution in the works involving hydrogen bond based on the direct determination of the interaction energy has become limited in order to characterize the electronic nature and interaction strength of the intermolecular system.
Boaz Galdino Oliveira
doaj   +1 more source

Intermolecular interaction of the Pi54 proteins with Avr-Pi54 protein.

, 2019
Intermolecular interaction of the Pi54 proteins with Avr-Pi54 protein.
Banita Kumari Saklani (7821677), Pankaj Kumar Singh (6667256), Tilak Raj Sharma (6667262), Chiranjib Sarkar (7821674), Ravi Kumar Asthana (7821680)   +4 more
core   +1 more source

Assessment of DFT functionals for calculating intermolecular interaction of nitrogen-containing heterocyclic complexes

, 2017
Nitrogen-containing heterocyclic complexes are important parts of many biological molecules including DNA, RNA, proteins and drug molecules, which often have weak intermolecular interactions.
Yun Wang, Guo, Tingting, Tingting Guo, Yin, Shiwei, Shiwei Yin, Wang, Yun   +5 more
core   +1 more source

Arsenic-Involving Intermolecular Interactions in Crystal Structures: The Dualistic Behavior of As(III) as Electron-Pair Donor and Acceptor [PDF]

, 2023
The element arsenic and its compounds pollute fresh water due to their toxicity and are a significant cause of human health problems in some countries. An important way to remove arsenic from freshwater uses intermolecular-interaction-based filters, e.g.
Yaser Balmohammadi, Yaser Balmohammadi (9749190), Simon Grabowsky, Balmohammadi, Yaser, Grabowsky, Simon, Simon Grabowsky (1347333)   +5 more
core   +1 more source

Profiling Intermolecular Interactions of Theophylline: Analysis of Some Classes of Theophylline Containing Co-Crystals

Crystals
Intermolecular interactions play an important role in the formation and stability of co-crystals. In this study, the interaction behaviour of theophylline in co-crystal structures was systematically analysed using data from the Cambridge Structural ...
Martin H. Polko, Guido J. Reiss
doaj   +1 more source

The Crystal Structures of 4-(1-Methylpiperidin-1-ium-1-yl)-2,2-Diphenylbutanamide Bromide and 4-(1-Methylpiperidin-1-ium-1-yl)-2,2-Diphenylbutanamide Bromide Hemihydrate

Molbank
Fenpiverinium is an agent which, from a medical perspective, has anticholinergic and antispasmodic properties, with applications in the treatment of smooth muscle spasm.
Ioana-Georgeta Grosu, Alexandru Turza, Gheorghe Borodi, Maria-Olimpia Miclaus   +3 more
doaj   +1 more source

Crystal structure and intermolecular interaction energy calculation in N,N′-bis(4-iodobenzylidene)-ethane-1,2-diamine [PDF]

شیمی کاربردی روز, 2019
A new potentially bidentate Schiff base ligand was synthesized from condensation reaction between ethylenediamine and 4-iodobenzaldehyde. The crystal structure of the compound was studied by single-crystal X-ray diffraction and it was shown that the ...
reza kia, Soheil Mahmoudi
doaj   +1 more source

Polymorphs of daidzein and intermolecular interaction effect on solution crystallization

, 2017
Polymorphs of DAID with enhanced dissolution rates were discovered and the intermolecular interaction effect on crystallization behavior was investigated.
Lina Jia, Junbo Gong, Shichao Du, Shijie Xu, Shiyuan Liu, Songgu Wu   +5 more
core   +1 more source

Engineering peptides into antibodies—opportunities and strategies for therapeutic innovation

FEBS Letters, EarlyView.
Peptides and antibodies occupy complementary therapeutic niches. Peptides recognize difficult targets in a compact format, while antibodies add specificity, long half‐life, and effector functions. This review examines strategies that merge both modalities—peptide grafting into loops, terminal and Fc fusions, and bioconjugation—highlighting how ...
Jinling Wang, Ruslana Romaniuk, Hristo L. Svilenov   +2 more
wiley   +1 more source