Arup Kumar Pathak (Arup K Pathak)

Publication Activity (10 Years)

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

Top Topics

Human Serum Albumin

Molecular Dynamics

Top Venues

Inorganic chemistry

Journal of biomolecular structure & dynamics

Physical chemistry chemical physics : PCCP

The journal of physical chemistry. B

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

Publications

Kamal R Chaudhari, Amey P Wadawale, Arup Kumar Pathak, Sandip Dey
Linkage Isomers of Triangular Pd Metallacycles and Catalysis in Aqueous Suzuki Coupling Reaction. Inorganic chemistry 63 (2) (2024)
Kamal R Chaudhari, Amey P Wadawale, Arup Kumar Pathak, Sandip Dey
Linkage Isomers of Triangular Pd Metallacycles and Catalysis in Aqueous Suzuki Coupling Reaction. Inorganic chemistry (2024)
Vijayakriti Mishra, Arup Kumar Pathak, Tusar Bandyopadhyay
Binding of human serum albumin with uranyl ion at various pH: an all atom molecular dynamics study. Journal of biomolecular structure & dynamics (2022)
Arup Kumar Pathak, Tusar Bandyopadhyay
Heat-induced transitions of an empty minute virus of mice capsid in explicit water: all-atom MD simulation. Journal of biomolecular structure & dynamics (2021)
Pravin A Mane, Sandip Dey, Arup Kumar Pathak, Mukesh Kumar, Nattamai Bhuvanesh
Xantphos-Capped Pd(II) and Pt(II) Macrocycles of Aryldithiolates: Structural Variation and Catalysis in C-C Coupling Reaction. Inorganic chemistry 58 (5) (2019)
Arup Kumar Pathak, Tusar Bandyopadhyay
Temperature Induced Dynamical Transition of Biomolecules in Polarizable and Nonpolarizable TIP3P Water. Journal of chemical theory and computation 15 (4) (2019)
Arup Kumar Pathak, Tusar Bandyopadhyay
Water isotope effect on the thermostability of a polio viral RNA hairpin: A metadynamics study. The Journal of chemical physics 146 (16) (2018)
Arup Kumar Pathak, Tusar Bandyopadhyay
Dynamic Mechanism of a Fluorinated Oxime Reactivator Unbinding from AChE Gorge in Polarizable Water. The journal of physical chemistry. B 122 (14) (2018)
Arup Kumar Pathak, Tusar Bandyopadhyay
Unbinding of fluorinated oxime drug from the AChE gorge in polarizable water: a well-tempered metadynamics study. Physical chemistry chemical physics : PCCP 19 (7) (2018)
Arup Kumar Pathak
An ab Initio Study on the Structure, Energetics, and Spectra of Cl-···(CO2)n Clusters. The journal of physical chemistry. A 120 (49) (2016)