| The effect of substituted 1, 2, 4-triazole moiety on the emission, phosphorescent properties of the blue emitting heteroleptic iridium (III) complexes and the OLED performance … R Srivastava, LR Joshi Physical Chemistry Chemical Physics 16 (32), 17284-17294, 2014 | 61 | 2014 |
| Theoretical studies on the molecular properties, toxicity, and biological efficacy of 21 new chemical entities R Srivastava ACS omega 6 (38), 24891-24901, 2021 | 58 | 2021 |
| The role of proton transfer on mutations R Srivastava Frontiers in Chemistry 7, 536, 2019 | 54 | 2019 |
| Physicochemical, antioxidant properties of carotenoids and its optoelectronic and interaction studies with chlorophyll pigments R Srivastava Scientific Reports 11 (1), 18365, 2021 | 26 | 2021 |
| Chemical reactivity theory (CRT) study of small drug-like biologically active molecules R Srivastava Journal of Biomolecular Structure and Dynamics 39 (3), 943-952, 2021 | 19 | 2021 |
| Complexes of DNA bases and Watson–Crick base pairs interaction with neutral silver Agn (n = 8, 10, 12) clusters: a DFT and TDDFT study R Srivastava Journal of Biomolecular Structure and Dynamics 36 (4), 1050-1062, 2018 | 16 | 2018 |
| On the viability of ruthenium (II) N-heterocyclic carbene complexes as dye-sensitized solar cell (DSSCs): A theoretical study R Srivastava Computational and Theoretical Chemistry 1045, 47-56, 2014 | 14 | 2014 |
| Applications of artificial intelligence multiomics in precision oncology R Srivastava Journal of cancer research and clinical oncology 149 (1), 503-510, 2023 | 12 | 2023 |
| Interaction of Cysteine with Aun (n=8, 10, 12) Even Neutral Clusters: A Theoretical Study R Srivastava ChemistrySelect 2 (9), 2789-2796, 2017 | 12 | 2017 |
| Recent development in optoelectronic devices R Srivastava BoD–Books on Demand, 2018 | 9 | 2018 |
| Theoretical study of electronic structures and optoelectronic properties of blue emitting heteroleptic Iridium (III) complexes containing 1, 1-dithiolates R Srivastava, Y Kada, B Kotamarthi Computational and Theoretical Chemistry 1009, 35-42, 2013 | 9 | 2013 |
| Application of optimization algorithms in clusters R Srivastava Frontiers in Chemistry 9, 637286, 2021 | 8 | 2021 |
| The effect of substituted moiety on the optoelectronic and photophysical properties of tris (phenylbenzimidazolinato) Ir (III) carbene complexes and the OLED performance: a … R Srivastava Molecular Physics 113 (12), 1451-1464, 2015 | 7 | 2015 |
| Theoretical study of electronic structures and opto-electronic properties of iridium (III) complexes containing benzoxazole derivatives and different ancillary β-diketonate ligands R Srivastava, L Joshi, B Kotamarthi Computational and Theoretical Chemistry 1035, 51-59, 2014 | 6 | 2014 |
| Chemical Reactivity and Optical and Pharmacokinetics Studies of 14 Multikinase Inhibitors and Their Docking Interactions Toward ACK1 for Precision Oncology R Srivastava Frontiers in Chemistry 10, 843642, 2022 | 5 | 2022 |
| Perovskite as light harvester: Prospects, efficiency, pitfalls and roadmap R Srivastava Nanostructured Solar Cells, 245-276, 2017 | 5 | 2017 |
| Theoretical studies on the electronic and optoelectronic properties of [A.2AP(w)/A*.2AP(WC)/C.2AP(w)/C*.2AP(WC)/C.A(w)/C*.A(WC)]–Au8 mismatch … R Srivastava Molecular Physics 116 (2), 263-272, 2018 | 4 | 2018 |
| Vibrational analysis of boldine hydrochloride using QM/MM approach N Misra, SA Siddiqui, R Srivastava, AK Pandey, S Jain Spectroscopy 24 (5), 483-499, 2010 | 4 | 2010 |
| Theoretical insight into the medicinal world of organometallics: macro versus nano R Srivastava Recent Progress in Organometallic Chemistry, 2017 | 3 | 2017 |
| Computational Studies on Antibody Drug Conjugates (ADCs) for Precision Oncology R Srivastava ChemistrySelect 7 (34), e202202259, 2022 | 2 | 2022 |
