| Adsorption of C 2 gases over CeO 2-based catalysts: synergism of cationic sites and anionic vacancies MC Padole, BP Gangwar, A Pandey, A Singhal, S Sharma, ... Physical Chemistry Chemical Physics 19 (21), 14148-14159, 2017 | 10 | 2017 |
| Tailoring Surface Adsorption and Reactivity of Fullerene-Based Compounds: A Theoretical Probe into C2–Gas–Fullerene Surface Interactions MC Padole, PA Deshpande The Journal of Physical Chemistry C 120 (23), 12654-12665, 2016 | 5 | 2016 |
| Enzyme–substrate interactions in orotate-mimetic OPRT inhibitor complexes: a QM/MM analysis S Kumar, NNS Rao, KP Reddy, MC Padole, PA Deshpande Physical Chemistry Chemical Physics 25 (4), 3472-3484, 2023 | 2 | 2023 |
| Mechanistic insights into C‐C cross coupling activities of Pd/Ni‐doped heterofullerenes MC Padole, PA Deshpande Journal of Physical Organic Chemistry 30 (12), e3696, 2017 | 2 | 2017 |
| Acid–Base Interactions in Halobenzene–Ceria Systems: Insights into Oxidative Addition from Theory MC Padole, PA Deshpande The Journal of Physical Chemistry C 120 (44), 25436-25444, 2016 | 2 | 2016 |
| Structural and electronic properties of chemically modified fullerenes MC Padole, PA Deshpande Molecular Simulation 45 (8), 623-635, 2019 | 1 | 2019 |
| Halobenzene activation by heterofullerenes: computational investigation of oxidative addition activity MC Padole, PA Deshpande Journal of Physical Organic Chemistry 30 (6), e3628, 2017 | 1 | 2017 |
| Systematic synthesis of pathways for hydrogenation and hydrogenolysis of acetylene over catalytic surfaces MC Padole, SP Misra, VSP Kumar, PA Deshpande Computer Aided Chemical Engineering 52, 2017-2022, 2023 | | 2023 |
| Torsion induced topological deformations in C60 MC Padole, SB Kotkar, PA Deshpande Materials Today Communications 27, 102201, 2021 | | 2021 |
| Ceria-Based Nanocrystalline Oxide Catalysts: Synthesis, Characterization, and Applications A Gupta, VSAIP KUMAR, M Padole, M Saharia, KBS KUMAR, ... Nanomaterials: Physical, Chemical, and Biological Applications, 203-237, 2018 | | 2018 |
| Computational Studies on Interaction of C2-Gases and Halobenzenes with Carbonaceous and Oxide Surfaces MC Padole IIT Kharagpur, 2018 | | 2018 |
| C59Pd: A novel heterogeneous catalytic material for Suzuki-Miyaura reaction MC Padole, PA Deshpande ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 253, 2017 | | 2017 |
