Milind Deshmukh - Dissemin

All papers authored by Milind Deshmukh

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2019 Anil Kumar

, Chen-Hsiung Hung, Shikha Rana, Milind M. Deshmukh

Study on the structure, stability and tautomerisms of meta-benziporphodimethene and N-Confused isomers containing γ–lactam ring

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Vijay Singh, Shigeyoshi Sakaki

, Milind M. Deshmukh

Theoretical prediction of Ni(I)‐catalyst for hydrosilylation of pyridine and quinoline

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2015 Nazia Siddiqui, Vijay Singh, Milind M. Deshmukh

, Ramanathan Gurunath

Structures, stability and hydrogen bonding in inositol conformers

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Milind M. Deshmukh

, Shridhar R. Gadre, Emilio Jose Cocinero

Stability of Conformationally Locked Free Fructose: Theoretical and Computational Insights

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2014 Brijesh Kumar Mishra, Milind Madhusudan Deshmukh

, Ramanathan Venkatnarayan

C–H···π Interactions and the Nature of the Donor Carbon Atom

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Milind Madhusudan Deshmukh

, Shigeyoshi Sakaki

Generation of Dihydrogen Molecule and Hydrosilylation of Carbon Dioxide Catalyzed by Zinc Hydride Complex: Theoretical Understanding and Prediction

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2013 Milind Madhusudan Deshmukh

, Masaaki Ohba, Susumu Kitagawa, Shigeyoshi Sakaki

Absorption of CO2 and CS2 into the Hofmann-Type Porous Coordination Polymer: Electrostatic versus Dispersion Interactions

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2012 Jayshree K. Khedkar, Milind M. Deshmukh

, Shridhar R. Gadre, Shridhar P. Gejji

Hydrogen Bond Energies and Cooperativity in Substituted Calix[n]arenes (n = 4, 5)

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Milind M. Deshmukh

, Shigeyoshi Sakaki

Two‐step evaluation of binding energy and potential energy surface of van der Waals complexes

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2011 Milind M. Deshmukh

, Shigeyoshi Sakaki

Binding energy of gas molecule with two pyrazine molecules as organic linker in metal-organic framework: Its theoretical evaluation and understanding of determining factors

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Milind M. Deshmukh

, Libero J. Bartolotti, Shridhar R. Gadre

Intramolecular hydrogen bond energy and cooperative interactions in α-, β-, and γ-cyclodextrin conformers

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2009 Milind M. Deshmukh

, Shridhar R. Gadre

Estimation of N-H···O-C intramolecular hydrogen bond energy in polypeptides

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2008 Milind M. Deshmukh

, Shridhar R. Gadre, Ralf Tonner, Gernot Frenking

Molecular electrostatic potentials of divalent carbon(0) compounds

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Milind M. Deshmukh

, Libero J. Bartolotti, Shridhar R. Gadre

Intramolecular Hydrogen Bonding and Cooperative Interactions in Carbohydrates via the Molecular Tailoring Approach

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2007 Milind M. Deshmukh

, Cherumuttathu H. Suresh, Shridhar R. Gadre

Intramolecular hydrogen bond energy in polyhydroxy systems: a critical comparison of molecular tailoring and isodesmic approaches

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2006 Milind M. Deshmukh

, Shridhar R. Gadre, Libero J. Bartolotti

Estimation of Intramolecular Hydrogen Bond Energy via Molecular Tailoring Approach

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Shridhar R. Gadre, Milind M. Deshmukh

, Rashmi P. Kalagi

Quantum Chemical Investigations on Explicit Molecular Hydration

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2004 Milind M. Deshmukh

, Nandhibatla V. Sastry, Shridhar R. Gadre

Molecular interpretation of water structuring and destructuring effects: Hydration of alkanediols

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Shridhar R. Gadre, Milind M. Deshmukh

, Tapas Chakraborty

Electrostatics-guided ab initio studies on weakly bonded complexes of substituted naphthalenes

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All papers authored by Milind Deshmukh