Experimental studies and computational modeling on cytochrome c reduction by quercetin: The role of oxidability and binding affinity
Publication date: 15 November 2021Source: Journal of Molecular Structure, Volume 1244Author(s): Gabriel Zazeri, Ana Paula Ribeiro Povinelli, Nathalia M. Pavan, Daniella Romano de Carvalho, Carmen Lúcia Cardoso, Valdecir Farias Ximenes (Source: Journal of Molecular Structure)
Source: Journal of Molecular Structure - July 8, 2021 Category: Molecular Biology Source Type: research

Investigation of spectroscopic, thermal, and biological properties of FeII, CoII, ZnII, and RuII complexes derived from azo dye ligand
Publication date: 15 November 2021Source: Journal of Molecular Structure, Volume 1244Author(s): Nevin Turan, Kenan Buldurun, Ragip Adiguzel, Abdülmelik Aras, Fikret Turkan, Ercan Bursal (Source: Journal of Molecular Structure)
Source: Journal of Molecular Structure - July 8, 2021 Category: Molecular Biology Source Type: research

Investigation of the new ammonium phosphate protonic conductor: Crystal structure, vibrational study, electric and dielectric properties.
Publication date: 15 November 2021Source: Journal of Molecular Structure, Volume 1244Author(s): I. Khlifi, I. Gouti, S. García-Granda, H. litaiem (Source: Journal of Molecular Structure)
Source: Journal of Molecular Structure - July 8, 2021 Category: Molecular Biology Source Type: research

Synthesis of different morphologies of metal and metal oxide nanoparticles and investigation of their catalytic properties by optical methods
Publication date: 15 November 2021Source: Journal of Molecular Structure, Volume 1244Author(s): Mahnaz Alizadeh, Mahmoud Zarei, Masoud Ebratkhahan, Mohammad Amjadi (Source: Journal of Molecular Structure)
Source: Journal of Molecular Structure - July 8, 2021 Category: Molecular Biology Source Type: research

The non-templating synthesis of macro-cyclic Schiff base ligands containing pyrrole and homopiperazine and their binuclear nickel(II), cobalt(II) and mononuclear platinum(II) complexes: X-ray single crystal and anticancer studies
Publication date: 15 November 2021Source: Journal of Molecular Structure, Volume 1244Author(s): Hamid Zeynali, Hassan Keypour, Leila Hosseinzadeh, Robert William Gable (Source: Journal of Molecular Structure)
Source: Journal of Molecular Structure - July 8, 2021 Category: Molecular Biology Source Type: research

Lone pair Halogen (X2)…π Interactions Stabilizes Molecular Halogens (X2=I2, Br2, Cl2, and F2) on Reduced Graphene Oxide surface: Structural, Solvent Effect and optical properties
Publication date: 15 November 2021Source: Journal of Molecular Structure, Volume 1244Author(s): Gaber A.M. Mersal, I.S. Yahia, Hamdy S. El-Sheshtawy (Source: Journal of Molecular Structure)
Source: Journal of Molecular Structure - July 8, 2021 Category: Molecular Biology Source Type: research

(2E)-2-(4-ethoxybenzylidene)-3,4-dihydro-2H-naphthalen-1-one single crystal: Synthesis, growth, crystal structure, spectral characterization, biological evaluation and binding interactions with SARS-CoV-2 main protease
Publication date: 15 November 2021Source: Journal of Molecular Structure, Volume 1244Author(s): N. Afsar, D. Reuben Jonathan, B.K. Revathi, Dhurairaj Satheesh, S. Manivannan (Source: Journal of Molecular Structure)
Source: Journal of Molecular Structure - July 8, 2021 Category: Molecular Biology Source Type: research

Synthesis and characterization of new thiazole-based Co(II) and Cu(II) complexes; therapeutic function of thiazole towards COVID-19 in comparing to current antivirals in treatment protocol
Publication date: 15 November 2021Source: Journal of Molecular Structure, Volume 1244Author(s): Samira A. Almalki, Tahani M. Bawazeer, Basim Asghar, Arwa Alharbi, Meshari M. Aljohani, Mohamed E. Khalifa, Nashwa El-Metwaly (Source: Journal of Molecular Structure)
Source: Journal of Molecular Structure - July 8, 2021 Category: Molecular Biology Source Type: research

Synthesis, molecular docking screening, ADMET and dynamics studies of synthesized 4-(4-methoxyphenyl)-8-methyl-3,4,5,6,7,8-hexahydroquinazolin-2(1H)-one and quinazolinone derivatives
Publication date: 15 November 2021Source: Journal of Molecular Structure, Volume 1244Author(s): M. Sarkar, A. Nath, A. Kumer, C. Mallik, F. Akter, Md. Moniruzzaman, Md. Ali (Source: Journal of Molecular Structure)
Source: Journal of Molecular Structure - July 8, 2021 Category: Molecular Biology Source Type: research

Two-trace two-dimensional (2T2D) correlation infrared spectral analysis of Spirulina platensis and its commercial food products coupled with chemometric analysis
Publication date: 15 November 2021Source: Journal of Molecular Structure, Volume 1244Author(s): E. Kavitha, L. Devaraj Stephen, Fatema Hossain Brishti, S. Karthikeyan (Source: Journal of Molecular Structure)
Source: Journal of Molecular Structure - July 8, 2021 Category: Molecular Biology Source Type: research

Synthesis, characterization, crystal structure, anti-cancer activities, and computational study of a novel thiophenylchromane
Publication date: 15 November 2021Source: Journal of Molecular Structure, Volume 1244Author(s): Samaneh Vaseghi, Saeed Emami, Mohamad Shokerzadeh, Zinatossadat Hossaini, Mohamad Yousefi (Source: Journal of Molecular Structure)
Source: Journal of Molecular Structure - July 8, 2021 Category: Molecular Biology Source Type: research

Spectroscopic characterization and binding interaction of heavy metal onto the surface receptor of the azobenzene: DFT and experimental approach
Publication date: 15 November 2021Source: Journal of Molecular Structure, Volume 1244Author(s): Marwa Chaabene, Soumaya Agren, Jamal El Haskouri, Abdul-Rahman Allouche, Lahcini Mohamed, Rafik Ben Chaâbane, Mohamed Hassen V Baouab (Source: Journal of Molecular Structure)
Source: Journal of Molecular Structure - July 8, 2021 Category: Molecular Biology Source Type: research

Effect of hydrocarbon chain length for acid corrosion inhibition of mild steel by three 8-(n-bromo-R-alkoxy)quinoline derivatives: Experimental and theoretical investigations
Publication date: 15 November 2021Source: Journal of Molecular Structure, Volume 1244Author(s): A. Tazouti, N. Errahmany, M. Rbaa, M. Galai, Z. Rouifi, R. Touir, A. Zarrouk, S. Kaya, M. Ebn Touhami, B. El Ibrahimi, S. Erkan (Source: Journal of Molecular Structure)
Source: Journal of Molecular Structure - July 8, 2021 Category: Molecular Biology Source Type: research

A 3D supramolecular framework assembled via π⋅⋅⋅π interactions and CH⋅⋅⋅Cl hydrogen-bonds with second-harmonic generation response
Publication date: 15 November 2021Source: Journal of Molecular Structure, Volume 1244Author(s): Xue-Li Cao, Yang Liu, Guo-Ling Li, Zi-Xiu Lu, Shun Li, Zhong-Min Cao, You-Gui Huang (Source: Journal of Molecular Structure)
Source: Journal of Molecular Structure - July 8, 2021 Category: Molecular Biology Source Type: research

Structural properties of a novel heterocyclic chalcones derivative, (E)-3-(5-methyl furan-2-yl)-1-phenyl prop‑2-en-1-one: A spectroscopic and DFT perception
Publication date: 15 November 2021Source: Journal of Molecular Structure, Volume 1244Author(s): Seema Shukla, Anubha Srivastava, Poonam Tandon, Joazaizulfazli Jamalis, R.B. Singh (Source: Journal of Molecular Structure)
Source: Journal of Molecular Structure - July 8, 2021 Category: Molecular Biology Source Type: research