Ponnadurai Ramasami

Orcid: 0000-0002-7272-3561

According to our database1, Ponnadurai Ramasami authored at least 18 papers between 2006 and 2024.

Collaborative distances:
  • Dijkstra number2 of six.
  • Erdős number3 of six.

Timeline

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Bibliography

2024
Empirical assessment of COVID-19 infections and information diffusion: a data science approach.
Int. J. Medical Eng. Informatics, 2024

2022
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.
J. Comput. Chem., 2022

2020
Activation Strain Analyses of Counterion and Solvent Effects on the Ion-Pair SN2 Reaction of and CH3Cl.
J. Comput. Chem., 2020

2019
ExcelAutomat 1.3: Fragment analysis based on the distortion/interaction-activation strain model.
J. Comput. Chem., 2019

2017
ExcelAutomat: a tool for systematic processing of files as applied to quantum chemical calculations.
J. Comput. Aided Mol. Des., 2017

2, 4-Ditellurouracil and its 5-fluoro derivative: Theoretical investigations of structural, energetics and ADME parameters.
Comput. Biol. Chem., 2017

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

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

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

Theoretical studies on cycloaddition reactions.
J. Cheminformatics, 2014

2013
First Principle Attempt towards the Thermodynamic Stability of Telluroformaldehyde and its Heavier Analogs: H<sub>(2-n)</sub>X<sub>(n)</sub>A=Te (X=H, F, Cl and Br; A=C, Si and Ge; n=0-2).
Proceedings of the International Conference on Computational Science, 2013

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.
Proceedings of the International Conference on Computational Science, 2013

2010
First principle study of the trans and gauche rotamers of 1, 2dihalogenodisilanes (XSiH<sub>2</sub>SiH<sub>2</sub>X; X=F, Cl, Br and I) in vacuum.
Proceedings of the International Conference on Computational Science, 2010

2009
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.
Proceedings of the Computational Science, 2009

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

3rd Workshop on Computational Chemistry and Its Applications (3rd CCA).
Proceedings of the Computational Science, 2008

2007
Theoretical Gas Phase Study of the Gauche and Trans Conformers of 1-Bromo-2-Chloroethane and Solvent Effects.
Proceedings of the Computational Science - ICCS 2007, 7th International Conference, Beijing, China, May 27, 2007

2006
Theoretical Gas Phase Study of the Gauche and Trans Conformers of 1-Fluoro-2-Haloethanes CH<sub>2</sub>F-CH<sub>2</sub>X (X=Cl, Br, I) by Ab Initio and Density Functional Methods: Absence of Gauche Effect.
Proceedings of the Computational Science, 2006


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