Theoretical insights into the mechanism of acetylcholinesterase-catalyzed acylation of acetylcholine. - T. K. Manojkumar; Chunzhi Cui; Kwang S. Kim (J. Comput. Chem., 2005)

Perturbations on prey predator equilibria: An in silico approach effect of epidemics on prey-predator system. - Anupama Paul; Aiswaria Lakshmi K. G.; Anitha V. R.; Reshma P; Reshmi Nair L. R.; Vidya Vinodini M. D.; T. K. Manojkumar (ICACCI, 2014)

Modeling of rice productivity in India. - Vidya Vinodini M. D.; Reshmi Nair L. R.; Aiswaria Lakshmi K. G.; Anitha V. R.; Reshma P; R. Ajith Kumar; T. K. Manojkumar (ICDSE, 2014)

Exploration of carboxyl functionalized eugenol for preventing metastasis of pancreatic cancer. - P. S. Arun; Lekshmysree S. Nair; Karlhik Manogaran; Vidya Vinodini M. D.; T. K. Manojkumar (ICACCI, 2015)

Pyranone Benzene complexes as potential nano-flippers: A DFT study. - Bindu P. Nair; T. K. Manojkumar; Sreedhar K. M.; Asraf V. Mohamed; Zainul Hukuman (ICACCI, 2015)

Forecasting of Annual Crime Rate in India: A case Study. - Manish Kumar; S. Athulya; M. B. Mary Minu; Vidya Vinodini M. D.; Aiswaria Lakshmi K. G.; S. Anjana; T. K. Manojkumar (ICACCI, 2018)

Computational study of molecular electrostatic potential, docking and dynamics simulations of gallic acid derivatives as ABL inhibitors. - K. R. Raghi; D. R. Sherin; M. J. Saumya; P. S. Arun; V. N. Sobha; T. K. Manojkumar (Comput. Biol. Chem., 2018)

Molecular docking, dynamics simulations and 3D-QSAR modeling of arylpiperazine derivatives of 3, 5-dioxo-(2H, 4H)-1, 2, 4-triazine as 5-HT1AR agonists. - D. R. Sherin; C. K. Geethu; Jaya Prabhakaran; J. John Mann; J. S. Dileep Kumar; T. K. Manojkumar (Comput. Biol. Chem., 2019)