| Study of a new piperidone as an anti-Alzheimer agent: Molecular docking, electronic and intermolecular interaction investigations by DFT method R Arulraj, S Sivakumar, M Medimagh, O Al-Dossary, N Issaoui, MJ Wojcik Journal of King Saud University - Science 33 (8), 101632, 2021 | 78 | 2021 |
| Synthesis, Crystal Structure, DFT Calculations and Hirshfeld Surface Analysis of 3-Chloro-2,6-Bis(4-Chlorophenyl)-3-Methylpiperidin-4-One A Ramalingam, S Kansız, N Dege, S Sambandam Journal of Chemical Crystallography 51 (2), 273-287, 2021 | 73 | 2021 |
| Synthesis, vibrational spectra, DFT calculations, Hirshfeld surface analysis and molecular docking study of 3-chloro-3-methyl-2,6-diphenylpiperidin-4-one R Arulraj, S Sivakumar, S Suresh, K Anitha Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 232 (118166), 2020 | 67 | 2020 |
| Synthesis, Crystal Structure, DFT Calculations and Hirshfeld Surface Analysis of 3-Chloro-3-methyl-r(2),c(6)-bis(p-methoxyphenyl)piperidin-4-one R Arulraj, S Sivakumar, K Rajkumar, JP Jasinski, M Kaur, A Thiruvalluvar Journal of Chemical Crystallography 50, 41-51, 2019 | 36 | 2019 |
| Hirshfeld surface analysis, Interaction energy calculation and spectroscopical study of 3-chloro-3-methyl-r(2),c(6)-bis(p-tolyl)piperidin-4-one using DFT approaches R Arulraj Journal of Molecular Structure 1248 (131483), 2022 | 34 | 2022 |
| Microwave assisted synthesis, vibrational spectra, Hirshfeld surface and interaction energy, DFT, topology, in silico ADMET and molecular docking studies of 1,2-bis(4 … S Ramkumar, R Rajalakshmi, R Arulraj, S Sivakumar, P Amalraj, ... Journal of Molecular Structure 1278 (134946), 2023 | 27 | 2023 |
| Synthesis, spectroscopic, topological, Hirshfeld surface analysis, and anti-covid-19 molecular docking investigation of isopropyl 1-benzoyl-4-(benzoyloxy)-2,6-diphenyl-1,2,5,6 … R Arulraj, K Murugavel, S Sivakumar, M Mouna, O Oluwatoba Emmanuel, ... Heliyon, e10831, 2022 | 27* | 2022 |
| Single crystal inspection, Hirshfeld surface investigation and DFT study of a novel derivative of 4-fluoroaniline: 4-((4-fluorophenyl) amino)-4-oxobutanoic acid (BFAOB) M Ashfaq, KS Munawar, G Bogdanov, A Ali, MN Tahir, G Ahmed, ... Journal of the Iranian Chemical Society, 1-9, 2021 | 27 | 2021 |
| Synthesis, vibrational spectra, Hirshfeld surface analysis, DFT calculations, and in silico ADMET study of 3-(2-chloroethyl)-2,6-bis(4-fluorophenyl)piperidin-4-one: A potent … R Arulraj, G Ahlam Roufieda, S Sivakumar, K Anitha, K Rajkumar, ... Journal of Molecular Structure, 133845, 2022 | 23 | 2022 |
| Synthesis, molecular docking of 3-(2-chloroethyl)-2,6-diphenylpiperidin-4-one: Hirshfeld surface, spectroscopic and DFT based analyses K Anitha, S Sivakumar, R Arulraj, K Rajkumar, A Dhandapani, ... Journal of Molecular Structure, 132993, 2022 | 23 | 2022 |
| Synthesis, crystal structure, DFT calculations and Hirshfeld surface analysis of 3-butyl-2,6-bis(4-fluorophenyl)piperidin-4-one K Anitha, S Sivakumar, R Arulraj, K Rajkumar, M Kaur, JP Jasinski Acta Crystallographica Section E: Crystallographic Communications 76 (5 …, 2020 | 18 | 2020 |
| Crystal structures of three 3-chloro-3-methyl-2,6-diarylpiperidin-4-ones R Arulraj, S Sivakumar, M Kaur, A Thiruvalluvar, JP Jasinski Acta Crystallographica Section E: Crystallographic Communications 73 (2 …, 2017 | 16 | 2017 |
| 3-Chloro-3-methyl-2,6-diarylpiperidin-4-ones as Anti-Cancer Agents: Synthesis, Biological Evaluation, Molecular Docking, and In Silico ADMET Prediction R Arulraj, M Nurulhuda, C Wee Joo, M Mouna, S Sivakumar, I Noureddine Biomolecules 12 (8), 1093, 2022 | 14 | 2022 |
| Synthesis, in vitro and in silico antitumor evaluation of 3-(2,6-dichlorophenyl)-1,5-diphenylpentane-1,5-dione: Structure, spectroscopic, RDG, Hirshfeld and DFT based analyses A Dhandapani, S Veeramanikandan, RS Kumar, AI Almansour, ... Journal of Molecular Structure, 132002, 2021 | 14 | 2021 |
| 3-Chloro-r-2,c-6-bis(4-fluorophenyl)-3-methylpiperidin-4-one R Arulraj, S Sivakumar, A Thiruvalluvar, M Kaur, JP Jasinski IUCrData 1 (10), x161580, 2016 | 14 | 2016 |
| Crystal structures of two new 3-(2-chloroethyl)-r(2),c(6)-diarylpiperidin-4-ones K Rajkumar, S Sivakumar, R Arulraj, M Kaur, JP Jasinski, A Manimekalai, ... Acta Crystallographica Section E: Crystallographic Communications 74 (4 …, 2018 | 13 | 2018 |
| X-Ray Crystal Structure, Molecular Structure, Spectral And Antimicrobial Activity of t-(3)-Benzyl-r-(2),c-(6)-diphenylpiperidin-4-one R Arulraj, S Sivakumar, A Thiruvalluvar, A Manimekalai Chemical Science Review and Letters 5 (18), 99-105, 2016 | 13 | 2016 |
| t-3-Benzyl-r-2,c-6-diphenylpiperidin-4-one oxime R Arulraj, S Sivakumar, A Thiruvalluvar, A Manimekalai IUCrData 1 (12), x161982, 2016 | 12 | 2016 |
| t-3-Benzyl-r-2,c-6-diphenylpiperidin-4-one R Arulraj, S Sivakumar, A Thiruvalluvar, A Manimekalai IUCrData 1 (2), x160188, 2016 | 12 | 2016 |
| Catalytic multicomponent synthesis, biological evaluation, molecular docking, and in silico ADMET studies of some novel 3-alkyl indoles R Rajalakshmi, R Arulraj, D Chinnaraja, S Sivakumar, I Noureddine, ... Journal of King Saud University-Science, 102475, 2022 | 9* | 2022 |
Noureddine ISSAOUIUniversité de Monastir, ISIMM, Laboratoire de physique quantique et statistique,Tunisie在 isimm.rnu.tn 的电子邮件经过验证
