Theoretical Gas Phase Study of the Gauche and Trans Conformers of 1-Fluoro-2-Haloethanes CH2F-CH2X (X=Cl, Br, I) by Ab Initio and Density Functional Methods: Absence of Gauche Effect. - Ponnadurai Ramasami (International Conference on Computational Science (3), 2006)

Theoretical Gas Phase Study of the Gauche and Trans Conformers of 1-Bromo-2-Chloroethane and Solvent Effects. - Ponnadurai Ramasami (International Conference on Computational Science (2), 2007)

3rd Workshop on Computational Chemistry and Its Applications (3rd CCA). - Ponnadurai Ramasami (ICCS (2), 2008)

First Principle Gas Phase Study of the Trans and Gauche Rotamers of 1, 2-Diisocyanoethane, 1, 2-Diisocyanodisilane and Isocyano(isocyanomethyl)silane. - Ponnadurai Ramasami (ICCS (2), 2008)

First Principle Study of the Anti- and Syn-Conformers of Thiophene-2-Carbonyl Fluoride and Selenophene-2-Carbonyl Fluoride in the Gas and Solution Phases. - Hassan H. Abdallah; Ponnadurai Ramasami (ICCS (2), 2009)

First principle study of the trans and gauche rotamers of 1, 2dihalogenodisilanes (XSiH2SiH2X; X=F, Cl, Br and I) in vacuum. - Ponnadurai Ramasami (ICCS, 2010)

TD-DFT Study of Excited-State Intramolecular Proton Transfer (ESIPT) of 2-(1, 3-benzothiazol-2-yl)-5-(N, N-diethylamino)Phenol with Benzoxazole and Benzimidazole Analogues. - Vikas Padalkar; Ponnadurai Ramasami; Nagaiyan Sekar (ICCS, 2013)

First Principle Attempt towards the Thermodynamic Stability of Telluroformaldehyde and its Heavier Analogs: H(2-n)X(n)A=Te (X=H, F, Cl and Br; A=C, Si and Ge; n=0-2). - Ponnadurai Ramasami; Naziah B. Jaufeerally (ICCS, 2013)

Theoretical studies on cycloaddition reactions. - Lydia Rhyman; Ponnadurai Ramasami; Luis R. Domingo (J. Cheminformatics, 2014)

Preface for the Special Issue of the Journal of Computational Science (Proceedings of the Virtual Conference on Computational Chemistry, VCCC-2013). - Ponnadurai Ramasami (J. Comput. Sci., 2014)

Perspectives of Virtual Conference on Computational Chemistry (VCCC-2014). - Ponnadurai Ramasami (J. Comput. Sci., 2015)

Proceedings of the Virtual Conference on Computational Science (VCCC-2015): Special Issue of the Journal of Computational Science. - Ponnadurai Ramasami (J. Comput. Sci., 2016)

2, 4-Ditellurouracil and its 5-fluoro derivative: Theoretical investigations of structural, energetics and ADME parameters. - Ibrahim A. Alswaidan; Kritish Sooknah; Lydia Rhyman; Cemal Parlak; Derek T. Ndinteh; Mohamed I. Elzagheid; Ponnadurai Ramasami (Comput. Biol. Chem., 2017)

ExcelAutomat: a tool for systematic processing of files as applied to quantum chemical calculations. - Jalal Z. A. Laloo; Nassirah Laloo; Lydia Rhyman; Ponnadurai Ramasami (J. Comput. Aided Mol. Des., 2017)

ExcelAutomat 1.3: Fragment analysis based on the distortion/interaction-activation strain model. - Jalal Z. A. Laloo; Nandini Savoo; Nassirah Laloo; Lydia Rhyman; Ponnadurai Ramasami (J. Comput. Chem., 2019)

Activation Strain Analyses of Counterion and Solvent Effects on the Ion-Pair SN2 Reaction of and CH3Cl. - Nandini Savoo; Jalal Z. A. Laloo; Lydia Rhyman; Ponnadurai Ramasami; Friedrich Matthias Bickelhaupt; Jordi Poater (J. Comput. Chem., 2020)

Decoding the reaction mechanism of the cyclocondensation of ethyl acetate2-oxo-2-(4-oxo-4H-pyrido [1.2-a] pyrimidin-3-yl) polyazaheterocycle and ethylenediamine using bond evolution theory. - Mbah Bake Maraf; Adjieufack Abel Idrice; Manwal A. Mekoung Pélagie; Auguste Abouem A. Zintchem; Gouet Bebga; Lydia Rhyman; Mbouombouo Ndassa Ibrahim; Ponnadurai Ramasami (J. Comput. Chem., 2022)

Empirical assessment of COVID-19 infections and information diffusion: a data science approach. - Isaac Kofi Nti; Adebayo Felix Adekoya; Owusu Nyarko-Boateng; Ponnadurai Ramasami (Int. J. Medical Eng. Informatics, 2024)