Shailesh Kumar Panday

According to our database, Shailesh Kumar Panday authored at least 9 papers between 2018 and 2026.

Collaborative distances:

• Dijkstra number of four.
• Erdős number of four.

2026

Accurate and Scalable Continuum Electrostatics for Large Biomolecular Systems: The <i>pyDelPhi</i> Poisson-Boltzmann Framework.

Shailesh Kumar Panday, Shan Zhao, Emil Alexov

J. Chem. Inf. Model., 2026

2025

<i>In Silico</i> Screening for Small Molecules to Alter Calpain Proteolysis through Modulating Conformation Changes Induced by Heterodimerization.

Pitambar Poudel, Ivan Shapovalov, Shailesh Kumar Panday, Kazem Nouri, Peter L. Davies, Peter A. Greer, Emil Alexov

J. Chem. Inf. Model., 2025

On delivering polar solvation free energy of proteins from energy minimized structures using a regularized super-Gaussian Poisson-Boltzmann model.

Shailesh Kumar Panday, Arghya Chakravorty, Shan Zhao, Emil Alexov

J. Comput. Chem., 2025

2024

SAAMBE-MEM: a sequence-based method for predicting binding free energy change upon mutation in membrane protein-protein complexes.

Prawin Rimal, Shailesh Kumar Panday, Wang Xu, Yunhui Peng, Emil Alexov

Bioinform., 2024

2021

SAMPDI-3D: predicting the effects of protein and DNA mutations on protein-DNA interactions.

Gen Li, Shailesh Kumar Panday, Yunhui Peng, Emil Alexov

Bioinform., 2021

2020

Capturing the Effects of Explicit Waters in Implicit Electrostatics Modeling: Qualitative Justification of Gaussian-Based Dielectric Models in DelPhi.

Arghya Chakravorty, Shailesh Kumar Panday, Swagata Pahari, Shan Zhao, Emil Alexov

J. Chem. Inf. Model., 2020

2019

DelPhi Suite: New Developments and Review of Functionalities.

Chuan Li, Zhe Jia, Arghya Chakravorty, Swagata Pahari, Yunhui Peng, Sankar Basu, Mahesh Koirala, Shailesh Kumar Panday, Marharyta Petukh, Lin Li, Emil Alexov

J. Comput. Chem., 2019

Reproducing ensemble averaged electrostatics with Super-Gaussian-based smooth dielectric function: application to electrostatic component of binding energy of protein complexes.

Shailesh Kumar Panday, Mihiri H. B. Shashikala, Arghya Chakravorty, Shan Zhao, Emil Alexov

Commun. Inf. Syst., 2019

2018

ProLego: tool for extracting and visualizing topological modules in protein structures.

Taushif Khan, Shailesh Kumar Panday, Indira Ghosh

BMC Bioinform., 2018