Milind M Deshmukh

Scopus Author ID ORCID

Publication Activity (10 Years)

Years Active: 2016-2024
Publications (10 Years): 26

Top Venues

The journal of physical chemistry. A

Physical chemistry chemical physics : PCCP

Journal of computational chemistry

Chemphyschem : a European journal of chemical physics and physical chemistry

Dr. Harisingh Gour Vishwavidyalay

North Maharashtra University (BSC)

This page only lists publications with an associated author ORCID identifier.

Affiliation History

Dr. Harisingh Gour Vishwavidyalay Nov 30 2013

India

Assistant Professor :: Department of Chemistry

Education History

North Maharashtra University Jan 06 1996 - Apr 01 1999

India

BSC :: P. O. Nahata College Bhusawal

Publications

Ayush Shivhare, Bharti Dehariya, Shridhar R Gadre, Milind M Deshmukh
On the synergetic effects of cyclic cooperativity in water clusters. Physical chemistry chemical physics : PCCP 26 (32) (2024)
Mini Bharati Ahirwar, Shridhar R Gadre, Milind M Deshmukh
Molecular Tailoring Approach for the Direct Estimation of Individual Noncovalent Interaction Energies in Molecular Systems. The journal of physical chemistry. A (2024)
Ayush Shivhare, Bharti Dehariya, Shridhar R Gadre, Milind M Deshmukh
On the synergetic effects of cyclic cooperativity in water clusters. Physical chemistry chemical physics : PCCP (2024)
Mini Bharati Ahirwar, Shridhar R Gadre, Milind M Deshmukh
Molecular Tailoring Approach for the Direct Estimation of Individual Noncovalent Interaction Energies in Molecular Systems. The journal of physical chemistry. A 128 (30) (2024)
Mini Bharati Ahirwar, Milind M Deshmukh
Two-Step ONIOM Method for the Accurate Estimation of Individual Hydrogen Bond Energy in Large Molecular Clusters. The journal of physical chemistry. A 127 (5) (2023)
Deepak Patkar, Milind M Deshmukh, Deepak Chopra
Characterization of non-covalent contacts in mono- and di-halo substituted acetaldehydes: probing the substitution effects of electron donating and withdrawing groups. Physical chemistry chemical physics : PCCP (2023)
Pankaj Lal Kalar, Kavita Jain, Swatantra Agrawal, Siddique Khan, Rampal Vishwakarma, Ayush Shivhare, Milind M Deshmukh, Kalpataru Das
Green Synthesis of Electrophilic Alkenes Using a Magnesium Catalyst under Aqueous Conditions and Mechanistic Insights by Density Functional Theory. The Journal of organic chemistry (2023)
Shashank Tripathi, Monty Kumar, Ayush Shivhare, Ruchir Kant, Milind M Deshmukh, Ajay Kumar Srivastava
Palladium(II)-Catalyzed Decarboxylative Difunctionalization of Alkynoic Acids To Access ( E )-β-Sulfonylacrylamides and DFT Study. Organic letters (2023)
Sumit K Rastogi, Richa Singh, Santosh Kumar, Abhishek Kumar Mishra, Mini Bharati Ahirwar, Milind M Deshmukh, Arun K Sinha, Ravindra Kumar
One-pot C-C, C-N, and C-S bond construction for synthesis of 3-sulfenylindoles directly from unactivated anilines involving dual palladium catalysis and mechanistic insights from DFT. Organic & biomolecular chemistry (2023)
Deepak Patkar, Milind M Deshmukh, Deepak Chopra
Characterization of non-covalent contacts in mono- and di-halo substituted acetaldehydes: probing the substitution effects of electron donating and withdrawing groups. Physical chemistry chemical physics : PCCP 25 (4) (2023)
Mini Bharati Ahirwar, Milind M Deshmukh
Fragments-in-fragments method for efficient and reliable estimates of individual hydrogen bond energies in large molecular clusters. Journal of computational chemistry (2023)
Mini Bharati Ahirwar, Shridhar R Gadre, Milind M Deshmukh
On the Short-Range Nature of Cooperativity in Hydrogen-Bonded Large Molecular Clusters. The journal of physical chemistry. A (2023)
Sumit K Rastogi, Richa Singh, Santosh Kumar, Abhishek Kumar Mishra, Mini Bharati Ahirwar, Milind M Deshmukh, Arun K Sinha, Ravindra Kumar
One-pot C-C, C-N, and C-S bond construction for synthesis of 3-sulfenylindoles directly from unactivated anilines involving dual palladium catalysis and mechanistic insights from DFT. Organic & biomolecular chemistry 21 (4) (2023)
Mini Bharati Ahirwar, Subodh S Khire, Shridhar R Gadre, Milind M Deshmukh
Hydrogen bond energy estimation (H-BEE) in large molecular clusters: A Python program for quantum chemical investigations. Journal of computational chemistry (2023)
Thufail M Ismail, Deepak Patkar, Pookkottu K Sajith, Milind M Deshmukh
Interplay of Hydrogen, Pnicogen, and Chalcogen Bonding in X(H 2 O) n =1-5 (X = NO, NO + , and NO - ) Complexes: Energetics Insights via a Molecular Tailoring Approach. The journal of physical chemistry. A (2023)
Deepak Patkar, Milind M Deshmukh, Deepak Chopra
Characterization of non-covalent contacts in mono- and di-halo substituted acetaldehydes: probing the substitution effects of electron donating and withdrawing groups. Physical chemistry chemical physics : PCCP 25 (4) (2023)
Mini Bharati Ahirwar, Milind M Deshmukh
Two-Step ONIOM Method for the Accurate Estimation of Individual Hydrogen Bond Energy in Large Molecular Clusters. The journal of physical chemistry. A (2023)
Deepak Patkar, Mini Bharati Ahirwar, Milind M Deshmukh
Energetic Ordering of Hydrogen Bond Strengths in Methanol-Water Clusters: Insights via Molecular Tailoring Approach. Chemphyschem : a European journal of chemical physics and physical chemistry 23 (10) (2022)
Deepak Patkar, Mini Bharati Ahirwar, Milind M Deshmukh
A Tug of War between the Self- and Cross-associating Hydrogen Bonds in Neutral Ammonia-Water Clusters: Energetic Insights by Molecular Tailoring Approach. Chemphyschem : a European journal of chemical physics and physical chemistry (2022)
Mini Bharati Ahirwar, Nalini D Gurav, Shridhar R Gadre, Milind M Deshmukh
Hydration shell model for expeditious and reliable individual hydrogen bond energies in large water clusters. Physical chemistry chemical physics : PCCP 24 (25) (2022)
Milind M Deshmukh, Shridhar R Gadre
Molecular Tailoring Approach for the Estimation of Intramolecular Hydrogen Bond Energy. Molecules (Basel, Switzerland) 26 (10) (2021)
Mini Bharati Ahirwar, Nalini D Gurav, Shridhar R Gadre, Milind M Deshmukh
Molecular Tailoring Approach for Estimating Individual Intermolecular Interaction Energies in Benzene Clusters. The journal of physical chemistry. A 125 (28) (2021)
Deepak Patkar, Mini Bharati Ahirwar, Shridhar R Gadre, Milind M Deshmukh
Unusually Large Hydrogen-Bond Cooperativity in Hydrogen Fluoride Clusters, (HF)n, n = 3 to 8, Revealed by the Molecular Tailoring Approach. The journal of physical chemistry. A 125 (40) (2021)
Mini Bharati Ahirwar, Shridhar R Gadre, Milind M Deshmukh
Direct and Reliable Method for Estimating the Hydrogen Bond Energies and Cooperativity in Water Clusters, Wn, n = 3 to 8. The journal of physical chemistry. A 124 (33) (2020)
Vijay Singh, Shigeyoshi Sakaki, Milind M Deshmukh
Theoretical prediction of Ni(I)-catalyst for hydrosilylation of pyridine and quinoline. Journal of computational chemistry 40 (24) (2019)
Vijay Singh, Yoshiaki Nakao, Shigeyoshi Sakaki, Milind M Deshmukh
Theoretical Study of Nickel-Catalyzed Selective Alkenylation of Pyridine: Reaction Mechanism and Crucial Roles of Lewis Acid and Ligands in Determining the Selectivity. The Journal of organic chemistry 82 (1) (2016)

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Publication Activity (10 Years)

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Milind M Deshmukh