Subodh S Khire

Publication Activity (10 Years)

Years Active: 2023-2024
Publications (10 Years): 5

Top Topics

Molecular Dynamics Simulations

Minimally Invasive

Single Molecule

Acute Heart Failure

Top Venues

The journal of physical chemistry. A

Chemphyschem : a European journal of chemical physics and physical chemistry

The Journal of chemical physics

Journal of computational chemistry

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

Publications

Subodh S Khire, Takahito Nakajima, Shridhar R Gadre
Cluster-in-Cluster Approach for Computing MP2-Level Vibrational Infrared Spectra of Large Molecular Clusters. The journal of physical chemistry. A 128 (18) (2024)
Subodh S Khire, Takahito Nakajima, Shridhar R Gadre
Cluster-in-Cluster Approach for Computing MP2-Level Vibrational Infrared Spectra of Large Molecular Clusters. The journal of physical chemistry. A (2024)
Subodh S Khire, Nandini Gattadahalli, Nalini D Gurav, Anmol Kumar, Shridhar R Gadre
Constructing Potential Energy Surface with Correlated Theory for Dipeptides Using Molecular Tailoring Approach. Chemphyschem : a European journal of chemical physics and physical chemistry (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)
Nityananda Sahu, Subodh S Khire, Shridhar R Gadre
Combining fragmentation method and high-performance computing: Geometry optimization and vibrational spectra of proteins. The Journal of chemical physics 159 (4) (2023)