1. A cytotoxicity, optical spectroscopy and computational binding analysis of 4‐[3‐acetyl‐5‐(acetylamino)‐2‐methyl‐2, 3‐dihydro‐1, 3, 4‐thiadiazole‐2‐yl]phenyl benzoate in calf thymus DNA. (26th March 2018) Authors: Karthikeyan, Subramani; Bharanidharan, Ganesan; Mangaiyarkarasi, Rajendiran; Chinnathambi, Shanmugavel; Sriram, Ragavan; Gunasekaran, Krishnaswamy; Saravanan, Kandasamy; Gopikrishnan, Mani; Aruna, Prakasarao; Ganesan, Singaravelu Journal: Luminescence Issue: Volume 33:Number 4(2018) Page Start: 731 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
2. Acylguanidine-BACE1 complex: Insights of intermolecular interactions and dynamics. (7th March 2019) Authors: Saravanan, Kandasamy; Kumaradhas, Poomani Journal: Journal of theoretical biology Issue: Volume 464(2019) Page Start: 33 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
3. Antibacterial and anticancer potential of marine endophytic actinomycetes Streptomyces coeruleorubidus GRG 4 (KY457708) compound against colistin resistant uropathogens and A549 lung cancer cells. (December 2018) Authors: Rajivgandhi, Govindan; Muneeswaran, Thillaichidambaram; Maruthupandy, Muthuchamy; Ramakritinan, Chockalingam Muthiah; Saravanan, Kandasamy; Ravikumar, Vilwanathan; Manoharan, Natesan Journal: Microbial pathogenesis Issue: Volume 125(2018) Page Start: 325 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
4. Binding and stability of indirubin-3-monoxime in the GSK3β enzyme: a molecular dynamics simulation and binding free energy study. Issue 4 (3rd March 2020) Authors: Saravanan, Kandasamy; Hunday, Govindasamy; Kumaradhas, Poomani Journal: Journal of biomolecular structure & dynamics Issue: Volume 38:Issue 4(2020) Page Start: 957 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
5. Discovery of new potential triplet acting inhibitor for Alzheimer's disease via X-ray crystallography, molecular docking and molecular dynamics. Issue 7 (2nd May 2020) Authors: Sivakumar, Maharajan; Saravanan, Kandasamy; Saravanan, Velautham; Sugarthi, Srinivasan; kumar, Shankar Madan; Alhaji Isa, Mustafa; Rajakumar, Perumal; Aravindhan, Sanmargam Journal: Journal of biomolecular structure & dynamics Issue: Volume 38:Issue 7(2020) Page Start: 1903 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
6. Growth, single crystal investigations, Hirshfeld surface analysis, DFT studies, molecular dynamics simulations, molecular docking, physico-chemical characterization and biological activity of novel thiocyanic complex with zinc transition metal precursor. (1st August 2022) Authors: Makhlouf, Jawher; El Bakri, Youness; Valkonen, Arto; Saravanan, Kandasamy; Ahmad, Sajjad; Smirani, Wajda Journal: Polyhedron Issue: Volume 222(2022) Page Start: Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
7. Insights into intermolecular interactions, electrostatic properties and the stability of C646 in the binding pocket of p300 histone acetyltransferase enzyme: a combined molecular dynamics and charge density study. Issue 12 (10th September 2018) Authors: Sivanandam, Magudeeswaran; Saravanan, Kandasamy; Kumaradhas, Poomani Journal: Journal of biomolecular structure & dynamics Issue: Volume 36:Issue 12(2018) Page Start: 3246 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
8. Investigation of intermolecular interactions and stability of verubecestat in the active site of BACE1: Development of first model from QM/MM-based charge density and MD analysis. Issue 9 (13th June 2019) Authors: Saravanan, Kandasamy; Sivanandam, Magudeeswaran; Hunday, Govindasamy; Mathiyalagan, Lakshmanan; Kumaradhas, Poomani Journal: Journal of biomolecular structure & dynamics Issue: Volume 37:Issue 9(2019) Page Start: 2339 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
9. Probing the intermolecular interactions, binding affinity, charge density distribution and dynamics of silibinin in dual targets AChE and BACE1: QTAIM and molecular dynamics perspective. Issue 23 (19th December 2022) Authors: Saravanan, Kandasamy; Sugarthi, Srinivasan; Suganya, Suresh; Kumaradhas, Poomani Journal: Journal of biomolecular structure & dynamics Issue: Volume 40:Issue 23(2022) Page Start: 12880 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
10. Salt formation, hydrogen‐bonding patterns and supramolecular architectures of acridine with salicylic and hippuric acid molecules. Issue 12 (19th November 2021) Authors: Suganya, Suresh; Saravanan, Kandasamy; Jaganathan, Ramakrishnan; Kumaradhas, Poomani Journal: Acta crystallographica Issue: Volume 77:Issue 12(2021) Page Start: 790 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗