1. Single crystal XRD, DFT investigations and molecular docking study of 2- ((1, 5-dimethyl-3-oxo-2-phenyl-2, 3-dihydro-1H-pyrazol-4-yl)amino)naphthalene-1, 4-dione as a potential anti- cancer lead molecule. (February 2019) Authors: P.R., Kavitha Rani; Mary, Y.Sheena; Fernandez, Annette; S, Anu Priya; Mary, Y.Shyma; Thomas, Renjith Journal: Computational biology and chemistry Issue: Volume 78(2019) Page Start: 153 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
2. Anti‐Cancerous Brucine and Colchicine: Experimental and Theoretical Characterization. Issue 39 (21st October 2019) Authors: Afzal, Aboothahir; Thayyil, Mohamed Shahin; Shariq, Mohammad; Mary, Yohannan Sheena; Resmi, Kaippallil Sundaresan; Thomas, Renjith; Islam, Nasarul; Abinu, Ajithan Jyothi Journal: ChemistrySelect Issue: Volume 4:Issue 39(2019) Page Start: 11441 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
3. Detailed quantum mechanical, molecular docking, QSAR prediction, photovoltaic light harvesting efficiency analysis of benzil and its halogenated analogues. Issue 11 (November 2019) Authors: Mary, Y. Shyma; Mary, Y. Sheena; Resmi, K.S.; Kumar, Veena S.; Thomas, Renjith; Sureshkumar, B. Journal: Heliyon Issue: Volume 5:Issue 11(2019) Page Start: Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
4. Syntheses, characterizations, crystal structures, DFT/TD‐DFT, luminescence behaviors and cytotoxic effect of bicompartmental Zn (II)‐dicyanamide Schiff base coordination polymers: An approach to apoptosis, autophagy and necrosis type classical cell death. (13th November 2019) Authors: Majumdar, Dhrubajyoti; Agrawal, Yashika; Thomas, Renjith; Ullah, Zakir; Santra, Manas K.; Das, Sourav; Pal, Tapan K.; Bankura, Kalipada; Mishra, Dipankar Journal: Applied organometallic chemistry Issue: Volume 34:Number 1(2020) Page Start: n/a Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
5. Quantum Mechanical Studies of Three Aromatic Halogen-Substituted Bioactive Sulfonamidobenzoxazole Compounds with Potential Light Harvesting Properties. (19th August 2021) Authors: Sheena Mary, Y.; Ertan-Bolelli, Tugba; Thomas, Renjith; Krishnan, Akhil R.; Bolelli, Kayhan; Kasap, Esin Nagihan; Onkol, Tijen; Yildiz, Ilkay Journal: Polycyclic aromatic compounds Issue: Volume 41:Number 7(2021) Page Start: 1563 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
6. Structural study of letrozole and metronidazole and formation of self-assembly with graphene and fullerene with the enhancement of physical, chemical and biological activities. Issue 15 (2nd September 2021) Authors: Almuqrin, Aljawhara H.; Al-Otaibi, Jamelah S.; Mary, Y. Sheena; Mary, Y. Shyma; Thomas, Renjith Journal: Journal of biomolecular structure & dynamics Issue: Volume 39:Issue 15(2021) Page Start: 5509 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
7. Structure, Spectral Features, Bioactivity and Light Harvesting Properties of Methyl and Dimethyl Anthracene: Experimental and First Principle Studies. (21st October 2021) Authors: Rao, D. Jagadeeswara; Mary, Y. Sheena; Mary, Y. Shyma; Resmi, K. S.; Thomas, Renjith Journal: Polycyclic aromatic compounds Issue: Volume 41:Number 9(2021) Page Start: 2003 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
8. Spectroscopic and Theoretical Studies of Potential Anti-Inflammatory Polycyclic Aromatic Fluorophenyl Substituted Acyclic and Heterocyclic Analogues Synthesized from 4, 4′-Difluorophenylchalcone. (14th September 2021) Authors: Sheena Mary, Y.; Shyma Mary, Y.; Thomas, Renjith; Resmi, K. S.; Narayana, B.; Samshuddin, S.; Sarojini, B. K. Journal: Polycyclic aromatic compounds Issue: Volume 41:Number 8(2021) Page Start: 1784 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
9. Markovnikov versus anti‐Markovnikov addition and C–H activation: Pd–Cu synergistic catalysis. (22nd October 2020) Authors: Ullah, Zakir; Thomas, Renjith Journal: Applied organometallic chemistry Issue: Volume 35:Number 1(2021) Page Start: n/a Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
10. Detailed Electronic Structure, Physico-Chemical Properties, Excited State Properties, Virtual Bioactivity Screening and SERS Analysis of Three Guanine Based Antiviral Drugs Valacyclovir HCl Hydrate, Acyclovir and Ganciclovir. (21st April 2022) Authors: Al-Otaibi, Jamelah S.; Mary, Y. Sheena; Thomas, Renjith; Kaya, Savaş Journal: Polycyclic aromatic compounds Issue: Volume 42:Number 4(2022) Page Start: 1260 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗