| An ab initio and DFT study of structure and vibrational spectra of γ form of Oleic acid: Comparison to experimental data S Mishra, D Chaturvedi, N Kumar, P Tandon, HW Siesler Chemistry and physics of lipids 163 (2), 207-217, 2010 | 49 | 2010 |
| Raman spectroscopic characterization of different regioisomers of monoacyl and diacyl chlorogenic acid PJ Eravuchira, RM El-Abassy, S Deshpande, MF Matei, S Mishra, ... Vibrational Spectroscopy, 2012 | 40 | 2012 |
| Quantum chemical study on influence of intermolecular hydrogen bonding on the geometry, the atomic charges and the vibrational dynamics of 2, 6-dichlorobenzonitrile P Agarwal, S Bee, A Gupta, P Tandon, VK Rastogi, S Mishra, P Rawat Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 121, 464-482, 2014 | 38 | 2014 |
| Molecular structure and vibrational spectroscopic investigation of secnidazole using density functional theory S Mishra, D Chaturvedi, P Tandon, VP Gupta, AP Ayala, SB Honorato, ... The Journal of Physical Chemistry A 113 (1), 273-281, 2009 | 26 | 2009 |
| Study on the structure and vibrational spectra of efavirenz conformers using DFT: Comparison to experimental data S Mishra, P Tandon, AP Ayala Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 88, 116-123, 2012 | 21 | 2012 |
| Quantum chemical and experimental studies on the structure and vibrational spectra of efavirenz S Mishra, D Chaturvedi, A Srivastava, P Tandon, AP Ayala, HW Siesler Vibrational Spectroscopy 53 (1), 112-116, 2010 | 19 | 2010 |
| Vibrational spectroscopy and density functional theory analysis of 3-< i> O</i>-Caffeoylquinic acid S Mishra, P Tandon, PJ Eravuchira, RM El-Abassy, A Materny Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 104, 358–367, 2013 | 16 | 2013 |
| Highly fluorescent water-soluble PTCA incorporated silver nano-cluster for sensing of dopamine T Goswami, A Bheemaraju, A Kataria, A Nag, K Sravani, S Mishra, ... Materials Chemistry and Physics 259, 124086, 2021 | 15 | 2021 |
| Vibrational dynamics of poly (β‐hydroxybutyrate)‐α form D Chaturvedi, S Mishra, P Tandon, VD Gupta, HW Siesler Polymer Engineering & Science 49 (5), 850-861, 2009 | 13 | 2009 |
| Two-Dimensional Correlation Analysis of Temperature-Dependent FT-IR Spectra of Oleic Acid M Unger, D Chaturvedi, S Mishra, P Tandon, HW Siesler Taylor & Francis Group, 2012 | 12 | 2012 |
| Molecular structure, vibrational spectroscopic, NBO and HOMO–LUMO studies of 2-amino 6-bromo 3-formylchromone A Gupta, S Bee, N Choudhary, S Mishra, P Tandon Molecular Simulation 38 (7), 567-581, 2012 | 12 | 2012 |
| Tuning of adsorption energies of CO2 and CH4 in borocarbonitrides BxCyNz: A first-principles study AK Mishra, S Mishra Journal of Molecular Graphics and Modelling 93, 107446, 2019 | 11 | 2019 |
| Molecular structure and vibrational spectroscopic analysis of an antiplatelet drug; clopidogrel hydrogen sulphate (form 2)–A combined experimental and quantum chemical approach A Srivastava, S Mishra, P Tandon, S Patel, AP Ayala, AK Bansal, ... Journal of Molecular Structure 964 (1-3), 88-96, 2010 | 11 | 2010 |
| Study of molecular structure and vibrational spectra of poly (β,-l-malic acid)[PMLA] using DFT approach D Chaturvedi, S Mishra, P Tandon, JA Portilla-Arias, S Muñoz-Guerra Polymer 53 (13), 2681-2690, 2012 | 7 | 2012 |
| Thermal degradation and theoretical interpretation of vibrational spectra of poly (β, l-malic acid) D Chaturvedi, S Mishra, P Tandon, JA Portilla-Arias, S Muñoz-Guerra Polymer 52 (14), 3118-3126, 2011 | 7 | 2011 |
| Conformational symmetry and vibrational dynamics of polymers P Tandon, N Kumar, V Gupta, D Chaturvedi, S Mishra, VD Gupta Pure and Applied Chemistry 81 (3), 549, 2010 | 7 | 2010 |
| A comparative study of vibrational dynamics of α-and β-forms of poly (β-hydroxybutyrate) D Chaturvedi, S Mishra, P Tandon, VD Gupta, HW Siesler Vibrational Spectroscopy 56 (1), 89-95, 2011 | 6 | 2011 |
| Effects of chlorpromazine drug on DPPC lipid: Density functional theory study S Mishra, AK Mishra International Journal of Environmental Analytical Chemistry 101 (12), 1773-1784, 2021 | 5 | 2021 |
| DFT study of structure and vibrational spectra of ceramide 3: comparison to experimental data S Mishra, P Tandon Molecular Simulation 38 (11), 872-881, 2012 | 5 | 2012 |
| Ab initio and experimental studies on structure and vibrational spectra of some partially reduced benzo [c] phenanthrenes VP Gupta, P Thul, S Mishra, R Pratap, VJ Ram Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 72 (1 …, 2009 | 4 | 2009 |
Abhishek Kumar MishraUniversity of Petroleum and Energy Studies (UPES), University College London, London. JNCASR在 ddn.upes.ac.in 的电子邮件经过验证
Abhishek Kumar MishraUniversity of Petroleum and Energy Studies (UPES), University College London, London. JNCASR在 ddn.upes.ac.in 的电子邮件经过验证