| Intramolecular hydrogen bonding and cooperative interactions in carbohydrates via the molecular tailoring approach MM Deshmukh, LJ Bartolotti, SR Gadre The Journal of Physical Chemistry A 112 (2), 312-321, 2008 | 118 | 2008 |
| Estimation of intramolecular hydrogen bond energy via molecular tailoring approach MM Deshmukh, SR Gadre, LJ Bartolotti The Journal of Physical Chemistry A 110 (45), 12519-12523, 2006 | 97 | 2006 |
| Estimation of N− H··· O C Intramolecular Hydrogen Bond Energy in Polypeptides MM Deshmukh, SR Gadre The Journal of Physical Chemistry A 113 (27), 7927-7932, 2009 | 93 | 2009 |
| Absorption of CO2 and CS2 into the Hofmann-Type Porous Coordination Polymer: Electrostatic versus Dispersion Interactions MM Deshmukh, M Ohba, S Kitagawa, S Sakaki Journal of the American chemical society 135 (12), 4840-4849, 2013 | 76 | 2013 |
| Intramolecular hydrogen bond energy in polyhydroxy systems: A critical comparison of molecular tailoring and isodesmic approaches MM Deshmukh, CH Suresh, SR Gadre The Journal of Physical Chemistry A 111 (28), 6472-6480, 2007 | 72 | 2007 |
| Molecular electrostatic potentials of divalent carbon (0) compounds MM Deshmukh, SR Gadre, R Tonner, G Frenking Physical Chemistry Chemical Physics 10 (17), 2298-2301, 2008 | 55 | 2008 |
| Intramolecular hydrogen bond energy and cooperative interactions in α‐, β‐, and γ‐cyclodextrin conformers MM Deshmukh, LJ Bartolotti, SR Gadre Journal of Computational Chemistry 32 (14), 2996-3004, 2011 | 49 | 2011 |
| Generation of dihydrogen molecule and hydrosilylation of carbon dioxide catalyzed by zinc hydride complex: theoretical understanding and prediction MM Deshmukh, S Sakaki Inorganic Chemistry 53 (16), 8485-8493, 2014 | 46 | 2014 |
| Molecular interpretation of water structuring and destructuring effects: Hydration of alkanediols MM Deshmukh, NV Sastry, SR Gadre The Journal of chemical physics 121 (24), 12402-12410, 2004 | 44 | 2004 |
| Hydrogen Bond Energies and Cooperativity in Substituted Calix[n]arenes (n = 4, 5) JK Khedkar, MM Deshmukh, SR Gadre, SP Gejji The Journal of Physical Chemistry A 116 (14), 3739-3744, 2012 | 40 | 2012 |
| Intramolecular Hydrogen Bonding 2021 MM Deshmukh, SR Gadre Intramolecular Hydrogen Bonding 2021, Eds. Jabłoński, Mirosław, 43-63, 2021 | 35* | 2021 |
| Direct and reliable method for estimating the hydrogen bond energies and cooperativity in water clusters, Wn, n= 3 to 8 MB Ahirwar, SR Gadre, MM Deshmukh The Journal of Physical Chemistry A 124 (33), 6699-6706, 2020 | 34 | 2020 |
| Theoretical study of nickel-catalyzed selective alkenylation of pyridine: reaction mechanism and crucial roles of Lewis acid and ligands in determining the selectivity V Singh, Y Nakao, S Sakaki, MM Deshmukh The Journal of Organic Chemistry 82 (1), 289-301, 2017 | 33 | 2017 |
| Ni (I)-hydride catalyst for hydrosilylation of carbon dioxide and dihydrogen generation: theoretical prediction and exploration of full catalytic cycle V Singh, S Sakaki, MM Deshmukh Organometallics 37 (8), 1258-1270, 2018 | 25 | 2018 |
| C–H··· π interactions and the nature of the donor carbon atom BK Mishra, MM Deshmukh, R Venkatnarayan The Journal of Organic Chemistry 79 (18), 8599-8606, 2014 | 19 | 2014 |
| Unusually Large Hydrogen-Bond Cooperativity in Hydrogen Fluoride Clusters,(HF) n, n= 3 to 8, Revealed by the Molecular Tailoring Approach D Patkar, MB Ahirwar, SR Gadre, MM Deshmukh The Journal of Physical Chemistry A 125 (40), 8836-8845, 2021 | 18 | 2021 |
| Appraisal of Individual Hydrogen Bond Strengths and Cooperativity in Ammonia Clusters via Molecular Tailoring Approach MB Ahirwar, D Patkar, I Yadav, MM Deshmukh Physical Chemistry Chemical Physics 23 (32), 17224-17231, 2021 | 18 | 2021 |
| Effect of substitutions on the geometry and intramolecular hydrogen bond strength in meta-benziporphodimethenes: A new porphyrin analogue D Ahluwalia, A Kumar, SG Warkar, MM Deshmukh Journal of Molecular Structure 1220, 128773, 2020 | 18 | 2020 |
| Molecular Tailoring Approach for Estimating Individual Intermolecular Interaction Energies in Benzene Clusters MB Ahirwar, ND Gurav, SR Gadre, MM Deshmukh The Journal of Physical Chemistry A 125 (28), 6131-6140, 2021 | 17 | 2021 |
| Structures, stability and hydrogen bonding in inositol conformers N Siddiqui, V Singh, MM Deshmukh, R Gurunath Physical Chemistry Chemical Physics 17 (28), 18514-18523, 2015 | 17 | 2015 |
Shridhar GadreDistinguished Professor, SPPU, Pune在 iitk.ac.in 的电子邮件经过验证
