Fragments-in-fragments method for efficient and reliable estimates of individual hydrogen bond energies in large molecular clusters. - Mini Bharati Ahirwar; Milind M. Deshmukh (J. Comput. Chem., 2023)

Hydrogen bond energy estimation (H-BEE) in large molecular clusters: A Python program for quantum chemical investigations. - Mini Bharati Ahirwar; Subodh Khire; Shridhar R. Gadre; Milind M. Deshmukh (J. Comput. Chem., 2024)

Appraisal of the Fragments-In-Fragments Method for the Energetics of Individual Hydrogen Bonds in Molecular Crystals. - Bharti Dehariya; Mini Bharati Ahirwar; Ayush Shivhare; Milind M. Deshmukh (J. Comput. Chem., 2025)