Sairam Swaroop Mallajosyula
VIDWAN ID: 53612

Dr Sairam Swaroop Mallajosyula

Male Doctor of Philosophy
Professor | Chemistry
Indian Institute of Technology, Gandhinagar
Gujarat
Expertise: Physical Chemistry
58 Publications
5 Projects
1659 Scopus Citations
2008 CrossRef
12 Years 9 Months Total Experience
Publications
58 Total
Articles
55
Chapters
3
Activity

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Scopus Scopus
1,659 Citations
18 h-index
CrossRef CrossRef
2,008 Citations
22 h-index
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Professional Recognition

Postdoctoral Fellowship
2009
School of Pharmacy, University of Maryland, Baltimore

Community & Membership

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Personal Details

Doctor of Philosophy
2009
National Institute of Pathology
Master of Science
2004
Kalasalingam Academy of Research and Education
Bachelor of Science
2002
Kalasalingam Academy of Research and Education
Professor
Jun 2026 – Present
Indian Institute of Technology, Gandhinagar | Chemistry
Associate Professor
Nov 2021 – Jun 2026
Indian Institute of Technology, Gandhinagar | Chemistry
Assistant Professor
Dec 2013 – Nov 2021
Indian Institute of Technology, Gandhinagar | Chemistry
Chemical Sciences
Physical Chemistry

Related Profiles

Scholarly Work

Profiling of Phytochemicals in Ayurvedic Medicinal Formulations and Understanding their Aggregation Behaviour
Other
Agency: Department of AYUSH Role: Principal Investigator
Utilizing Molecular Dynamics Simulations to Study Graphene Nanopores as Functional Materials for DNA Sequencing
Completed
Role: Principal Investigator
Atomistic insight into the structural influences of competitive post- translational modifications; Phosphorylation and O-GlcNAcylation
Completed
Agency: Department of Bio-Technology Role: Principal Investigator
Theoretical investigations of carbohydrate-water interactions
Completed
Role: Principal Investigator
Theoretical investigations of carbohydrate protein linkages: Elucidating the O-GlcNAc transferase mechanism and gaining insights into structure and function
Completed
Role: Principal Investigator

Theoretical Investigation of Carbohydrates and Glycoproteins: Elucidating Structure, Function and Mechanism

University Indian Institute of Technology Gandhinagar
Year 2019
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Computational Insights into Two Competitive Protein Post-Translational Modifications: Phosphorylation and O-GlcNAcylation

University Indian Institute of Technology Gandhinagar
Year 2020
Downloads 0

Polarizable Simulations of Nuceobase-Graphene Interactions and Electrolyte Effects: Insights into Nano-Bio Interfaces

University Indian Institute of Technology Gandhinagar
Year 2024
Downloads 0

Capturing the Ring Conformational Dynamics of Hexopyranoses: Polarization Effects, Force Field Refinements and Quantum Mechanical Investigations

University Indian Institute of Technology Gandhinagar
Year 2025
Downloads 0
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Scholarly Publications

Computational Studies on Molecules with Unusual Aromaticity: What to Expect?

Book Chapter
Year: 2010. Pages: 69-94 .

Correction to: Classification of the human THAP protein family identifies an evolutionarily conserved coiled coil region (BMC Structural Biology (2019) 19 (4) DOI: 10.1186/s12900-019-0102-2)

Open Access
Erratum
BMC Structural Biology. Year: 2019. Volume: 19 , Issue: 1 .
Authors: Hiral M. Sanghavi; Sairam S. Mallajosyula; Sharmistha Majumdar

Unravelling amino acid–graphene interactions: insights from polarizable force field simulations

Journal Article
Nanoscale. Year: 2025. Volume: 17 , Issue: 47 , Pages: 27624-27636 .
Authors: Sahil Soni; Ripan Halder; Mayank Luniwal; Sairam S. Mallajosyula

CHARMM Force Field for Curcuma longa Phytochemicals: Towards Reliable Modeling of Curcuminoids and Turmerones in Biological Systems

Journal Article
JOURNAL OF COMPUTATIONAL CHEMISTRY. Year: 2026. Volume: 47 , Issue: 8 .
Authors: Archana; Vaibhav Charde; Vijay Kumar; Anagha Ranade; Ajay K. Meena; Narayanam Srikanth; Rabinarayan Acharya; Sairam S. Mallajosyula

Role of Ni and Co Phosphate–MWCNT Interactions in Enhancing Morphine Electrosensing Performance

Journal Article
Langmuir. Year: 2026. Volume: 42 , Issue: 20 , Pages: 14253-14267 .
Authors: Puneet Kumar; Siddharth Sameer; Ruturaj Solanki; Ripan Halder; Preeti Parmar; Neha Anil; Sairam Swaroop Mallajosyula; Nilesh R. Manwar; Bappi Paul

Development and Validation of CHARMM Force Field Parameters for Major Phytochemicals of Phyllanthus emblica

Journal Article
JOURNAL OF COMPUTATIONAL CHEMISTRY. Year: 2026. Volume: 47 , Issue: 16 .
Authors: Neha Arya; Vaibhav Charde; Vijay Kumar; Anagha Ranade; Ajay K. Meena; Narayanam Srikanth; Rabinarayan Acharya; Sairam S. Mallajosyula

Structure and electronic properties of the Watson–Crick base pairs: Role of hydrogen bonding

Journal Article
Synthetic Metals. Year: 2005. Volume: 155 , Issue: 2 , Pages: 398-401 .
Authors: Sairam S. Mallajosyula; Ayan Datta; Swapan K. Pati

Quantifying Aromaticity at the Molecular and Supramolecular Limits:  Comparing Homonuclear, Heteronuclear, and H-Bonded Systems

Journal Article
Journal of Chemical Theory and Computation. Year: 2006. Volume: 2 , Issue: 1 , Pages: 30-36 .
Authors: Abdul Rehaman; Ayan Datta; Sairam S. Mallajosyula; Swapan K. Pati
Showing 1 to 8 of 58 publications