Search Results - "Thamotharan, Subbiah"

Comments on “influence of procion red dye doping on the structural, dielectric and optical properties of diglycine phthalic acid single crystals for nonlinear optical applications”.

Authors: Petrosyan, Aram M. Thamotharan, Subbiah Srinivasan, Bikshandarkoil R.

Source: Journal of Materials Science: Materials in Electronics; Jan2025, Vol. 36 Issue 1, p1-3, 3p

Editorial: Noncovalent interactions in N/O heterocycles.

Authors: Thamotharan, Subbiah Percino, M. Judith Gil, Diego Mauricio

Source: Frontiers in Chemistry. 2025, p1-2. 2p.

NHC Organocatalysis in D2O for the Highly Diastereoselective Synthesis of Deuterated Spiropyran Analogues.

Authors: Suresh, Pavithira Thamotharan, Subbiah Selva Ganesan, Subramaniapillai

Source: ChemistrySelect. 3/5/2021, Vol. 6 Issue 9, p2036-2040. 5p.

Small-Molecule:Polymer Composites for Transparent Films with Visible Emission.

Authors: Pérez-Gutiérrez, Enrique Calvo, Franciso D. Beristain, Miriam F. et al.

Source: Journal of Fluorescence. Jun2025, Vol. 35 Issue 6, p4889-4900. 12p.

Weak noncovalent interactions in 1,2,4-triazole-3-thione-linked adamantyl derivatives: experimental and computational insights into their potential as antiproliferative agents.

Authors: Al-Wahaibi, Lamya H. Chakraborty, Annesha Hassan, Hanan M. et al.

Source: Frontiers in Chemistry. 2025, p1-19. 19p.

Experimental and computational investigations of two N′-(adamantan-2-ylidene)-substituted benzohydrazide derivatives: crystal structures, antiproliferative activity, molecular docking, and molecular dynamics simulations.

Authors: Al-Wahaibi, Lamya H. Chakraborty, Annesha Warda, Eman T. et al.

Source: Structural Chemistry. Dec2025, Vol. 36 Issue 6, p2319-2336. 18p.

Comprehensive synthesis and characterization of a novel Fe–porphyrin complex: crystal structure, spectroscopic investigations, Hirshfeld surface analysis, and computational modeling (DFT, QTAIM-NCI/ELF).

Authors: Dhifet, Mondher Guelmami, Lelfia Zaki, Khadija et al.

Source: Frontiers in Chemistry. 2025, p1-17. 17p.

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Thiophene-Linked 1,2,4-Triazoles: Synthesis, Structural Insights and Antimicrobial and Chemotherapeutic Profiles †.

Authors: El-Emam, Nada A. El-Ashmawy, Mahmoud B. Mohamed, Ahmed A. B. et al.

Source: Pharmaceuticals (14248247). Sep2024, Vol. 17 Issue 9, p1123. 25p.

Serendipitous Synthesis of an Octahedral Ni(II) Complex: Single Crystal Structure, Hirshfeld Surface and Voids Analysis.

Authors: Göktürk, T. Topkaya, C. G. Hökelek, T. et al.

Source: Journal of Structural Chemistry. Jan2024, Vol. 65 Issue 1, p15-27. 13p.

¹H‐NMR, Photophysical, and pH Studies of 4‐(4,5‐Diphenyl‐1H‐imidazol‐2‐yl)benzaldehyde through Experimental and DFT Theoretical Analysis.

Authors: Anandhan, Karnambaram Cerón, Margarita Ceballos, Paulina et al.

Source: ChemistrySelect. 1/9/2020, Vol. 5 Issue 1, p415-425. 11p.

Synthesis and in vitro antibacterial, antifungal, anti-proliferative activities of novel adamantane-containing thiazole compounds.

Authors: Warda, Eman T. El-Ashmawy, Mahmoud B. Habib, El-Sayed E. et al.

Source: Scientific Reports. 12/6/2022, Vol. 12 Issue 1, p1-15. 15p.

X-ray Structures and Computational Studies of Two Bioactive 2-(Adamantane-1-carbonyl)- N -substituted Hydrazine-1-carbothioamides.

Authors: Al-Wahaibi, Lamya H. Alagappan, Kowsalya Blacque, Olivier et al.

Source: Molecules. Dec2022, Vol. 27 Issue 23, p8425. 18p.

Weak Noncovalent Interactions in Three Closely Related Adamantane-Linked 1,2,4-Triazole N -Mannich Bases: Insights from Energy Frameworks, Hirshfeld Surface Analysis, In Silico 11β-HSD1 Molecular Docking and ADMET Prediction.

Authors: Al-Wahaibi, Lamya H. Macías, Mario A. Blacque, Olivier et al.

Source: Molecules. Nov2022, Vol. 27 Issue 21, p7403. 27p.

TBHP Mediated Substrate Controlled Oxidative Dearomatization of Indoles to C2/C3-Quaternary Indolinones.

Authors: Kothandapani, Jagatheeswaran Reddy, Singarajanahalli Mundarinti Krishna Thamotharan, Subbiah et al.

Source: European Journal of Organic Chemistry. 6/15/2018, Vol. 2018 Issue 22, p2762-2767. 6p. 3 Diagrams, 2 Charts.

Quantitative analysis of intermolecular interactions in 2,2’-((4-bromophenyl)methylene)bis(3-hydroxy-5,5-dimethylcyclohex-2-en-1-one): insights from crystal structure, PIXEL, Hirshfeld surfaces and QTAIM analysis.

Authors: Thamotharan, Subbiah Kothandapani, Jagatheeswaran Selva Ganesan, Subramaniapillai et al.

Source: Journal of Chemical Sciences. Feb2018, Vol. 130 Issue 2, pN.PAG-N.PAG. 1p.

Discovering TEAD4 modulators for hepatocellular carcinoma: a GAN-enabled generative modelling framework.

Authors: Premnath V Karuppasamy R Kaliappan J et al.

Source: Frontiers in bioinformatics [Front Bioinform] 2026 May 04; Vol. 6, pp. 1811161. Date of Electronic Publication: 2026 May 04 (Print Publication: 2026).

Publication Type: Journal Article

Journal Info: Publisher: Frontiers Media S.A Country of Publication: Switzerland NLM ID: 9918227263306676 Publication Model: eCollection Cited Medium: Internet ISSN: 2673-7647 (Electronic) Linking ISSN: 26737647 NLM ISO Abbreviation: Front Bioinform Subsets: PubMed not MEDLINE

Structural Insights of Three 2,4-Disubstituted Dihydropyrimidine-5-carbonitriles as Potential Dihydrofolate Reductase Inhibitors.

Authors: Al-Wahaibi, Lamya H. Shaik, Althaf Elmorsy, Mohammed A. et al.

Source: Molecules. Jun2021, Vol. 26 Issue 11, p3286. 1p.

Solution and Solid-State Photophysical Properties of Positional Isomeric Acrylonitrile Derivatives with Core Pyridine and Phenyl Moieties: Experimental and DFT Studies.

Authors: Castillo, Armando Ceballos, Paulina Santos, Pilar et al.

Source: Molecules. Mar2021, Vol. 26 Issue 6, p1500-1500. 1p.