Ponnadurai Ramasami (P Ramasami)

Publication Activity (10 Years)

Years Active: 2016-2024
Publications (10 Years): 17

Top Topics

Molecular Dynamics Simulations

Top Venues

Chemphyschem : a European journal of chemical physics and physical chemistry

Chemistry (Weinheim an der Bergstrasse, Germany)

Journal of computational chemistry

This page only lists publications with an associated author ORCID identifier.

Publications

Ponnadurai Ramasami, Jane S Murray
Radial Behavior of Electrostatic Potentials of Atoms and Ions Revisited: Isotropy and Anisotropy. Chemphyschem : a European journal of chemical physics and physical chemistry (2024)
Ponnadurai Ramasami, Jane S Murray
Radial Behavior of Electrostatic Potentials of Atoms and Ions Revisited: Isotropy and Anisotropy. Chemphyschem : a European journal of chemical physics and physical chemistry 25 (17) (2024)
Ponnadurai Ramasami, Jane S Murray
Radial Behavior of Electrostatic Potentials of Atoms and Ions Revisited: Isotropy and Anisotropy. Chemphyschem : a European journal of chemical physics and physical chemistry 25 (17) (2024)
T O Daniel, Lydia Rhyman, Ponnadurai Ramasami
Exploring the Efficiency of C343 Coumarin Dye-Sensitized Solar Cells Using Substituents. The journal of physical chemistry. A (2024)
Divya Bhikharee, Lydia Rhyman, Ponnadurai Ramasami
Computational study of the interaction of the psychoactive amphetamine with 1,2-indanedione and 1,8-diazafluoren-9-one as fingerprinting reagents. RSC advances 13 (6) (2023)
Divya Bhikharee, Lydia Rhyman, Ponnadurai Ramasami
Computational study of the interaction of the psychoactive amphetamine with 1,2-indanedione and 1,8-diazafluoren-9-one as fingerprinting reagents. RSC advances 13 (6) (2023)
Nandini Savoo, Lydia Rhyman, Ponnadurai Ramasami
Theoretical study of a derivative of chlorophosphine with aliphatic and aromatic Grignard reagents: S N 2@P or the novel S N 2@Cl followed by S N 2@C? RSC advances 12 (15) (2022)
Luis R Domingo, Mar Ríos-Gutiérrez, Rishikesh Chulan, M H H Mahmoud, Mohamed M Ibrahim, Salah M El-Bahy, Lydia Rhyman, Ponnadurai Ramasami
Unveiling the non-polar [3+2] cycloaddition reactions of cyclic nitrones with strained alkylidene cyclopropanes within a molecular electron density theory study. RSC advances 12 (39) (2022)
Misbaudeen Abdul-Hammed, Ibrahim Olaide Adedotun, Monsurat Olajide, Christianah Otoame Irabor, Tolulope Irapada Afolabi, Ibrahim Olajide Gbadebo, Lydia Rhyman, Ponnadurai Ramasami
Virtual screening, ADMET profiling, PASS prediction, and bioactivity studies of potential inhibitory roles of alkaloids, phytosterols, and flavonoids against COVID-19 main protease (Mpro). Natural product research (2021)
Yadhav A Imrit, Hanusha Bhakhoa, Tetiana Sergeieva, Sergi Danés, Nandini Savoo, Mohamed I Elzagheid, Lydia Rhyman, Diego M Andrada, Ponnadurai Ramasami
A theoretical study of the hydrolysis mechanism of A-234; the suspected novichok agent in the Skripal attack. RSC advances 10 (47) (2020)
Hanusha Bhakhoa, Lydia Rhyman, Ponnadurai Ramasami
Theoretical study of the molecular aspect of the suspected novichok agent A234 of the Skripal poisoning. Royal Society open science 6 (2) (2019)
Nandini Savoo, Jalal Z A Laloo, Lydia Rhyman, Ponnadurai Ramasami, Friedrich Matthias Bickelhaupt, Jordi Poater
Activation Strain Analyses of Counterion and Solvent Effects on the Ion-Pair SN 2 Reaction of NH 2 - and CH3 Cl. Journal of computational chemistry 41 (4) (2019)
Christopher M Timperley, Jonathan E Forman, Pal Åas, Mohammad Abdollahi, Djafer Benachour, Abdullah Saeed Al-Amri, Augustin Baulig, Renate Becker-Arnold, Veronica Borrett, Flerida A Cariño, Christophe Curty, David Gonzalez, Michael Geist, William Kane, Zrinka Kovarik, Roberto Martínez-Álvarez, Robert Mikulak, Nicia Maria Fusaro Mourão, Slawomir Neffe, Evandro De Souza Nogueira, Ponnadurai Ramasami, Syed K Raza, Valentin Rubaylo, Ahmed E M Saeed, Koji Takeuchi, Cheng Tang, Ferruccio Trifirò, Francois Mauritz van Straten, Alejandra G Suárez, Farhat Waqar, Paula S Vanninen, Mohammad Zafar-Uz-Zaman, Slavica Vučinić, Volodymyr Zaitsev, Mongia Saïd Zina, Stian Holen, Fauzia Nurul Izzati
Advice from the Scientific Advisory Board of the Organisation for the Prohibition of Chemical Weapons on riot control agents in connection to the Chemical Weapons Convention. RSC advances 8 (73) (2018)
Jalal Z A Laloo, Nandini Savoo, Nassirah Laloo, Lydia Rhyman, Ponnadurai Ramasami
ExcelAutomat 1.3: Fragment analysis based on the distortion/interaction-activation strain model. Journal of computational chemistry 40 (3) (2018)
Dhanashree Hallooman, Mar Ríos-Gutiérrez, Lydia Rhyman, Ibrahim A Alswaidan, Luis R Domingo, Ponnadurai Ramasami
DFT exploration of [3 + 2] cycloaddition reaction of 1 H -phosphorinium-3-olate and 1-methylphosphorinium-3-olate with methyl methacrylate. RSC advances 8 (48) (2018)
Hanusha Bhakhoa, Lydia Rhyman, Edmond P F Lee, Ponnadurai Ramasami, John M Dyke
Can Cyclen Bind Alkali Metal Azides? A DFT Study as a Precursor to Synthesis. Chemistry (Weinheim an der Bergstrasse, Germany) 22 (13) (2016)
Jalal Z A Laloo, Lydia Rhyman, Ponnadurai Ramasami, Friedrich Matthias Bickelhaupt, Abel de Cózar
Ion-Pair SN 2 Substitution: Activation Strain Analyses of Counter-Ion and Solvent Effects. Chemistry (Weinheim an der Bergstrasse, Germany) 22 (13) (2016)