Milind M. Deshmukh

Publication Activity (10 Years)

Years Active: 2011-2024
Publications (10 Years): 3

Top Topics

Clustering Algorithm

Chemical Reaction

High Prediction Accuracy

Top Venues

J. Comput. Chem.

Publications

Mini Bharati Ahirwar, Subodh Khire, Shridhar R. Gadre, Milind M. Deshmukh
Hydrogen bond energy estimation (H-BEE) in large molecular clusters: A Python program for quantum chemical investigations. J. Comput. Chem. 45 (5) (2024)
Mini Bharati Ahirwar, Milind M. Deshmukh
Fragments-in-fragments method for efficient and reliable estimates of individual hydrogen bond energies in large molecular clusters. J. Comput. Chem. 44 (23) (2023)
Vijay Singh, Shigeyoshi Sakaki, Milind M. Deshmukh
Theoretical prediction of Ni(I)-catalyst for hydrosilylation of pyridine and quinoline. J. Comput. Chem. 40 (24) (2019)
Milind M. Deshmukh, Shigeyoshi Sakaki
Two-step evaluation of binding energy and potential energy surface of van der Waals complexes. J. Comput. Chem. 33 (6) (2012)
Milind M. Deshmukh, Libero J. Bartolotti, Shridhar R. Gadre
Intramolecular hydrogen bond energy and cooperative interactions in α-, β-, and γ-cyclodextrin conformers. J. Comput. Chem. 32 (14) (2011)