Publications
18
Citations
350
Est. group size
~1
Recurring co-author estimate
Active years
7
Publishing since 2019
Imrul Shahriar works in physical and computational chemistry, combining laboratory experiments (like measuring electrical conductivity of surfactant solutions) with computer simulations (molecular dynamics and docking) to study how molecules interact with each other. Their work spans surfactant behavior in water and drug solutions, protein structure analysis related to disease-causing mutations, and computational design of drug candidates for conditions like Alzheimer's disease, tuberculosis, and viral infections including SARS-CoV-2.
Publication output has been relatively steady but modest over the past decade, peaking at 5 papers in 2019 and averaging about 1.6 papers per year over the last five years.
Generated by claude-sonnet-5 from public bibliographic data · Jul 20, 2026
- Histidine Focused Covalent Inhibitors Targeting Acetylcholinesterase: A Computational Pipeline for Multisite Therapeutic Discovery in Alzheimer’s Disease
ACS Chemical Neuroscience · 2025
- Investigation of the impact of nonsynonymous mutations on thyroid peroxidase dimer
PLoS ONE · 2023
- Experimental and computational studies on transition metals interaction with Leucine and Isoleucine
Journal of Molecular Structure · 2022
- Improving the binding affinity and interaction of 5-Pentyl-2-Phenoxyphenol against Mycobacterium Enoyl ACP reductase by computational approach
Informatics in Medicine Unlocked · 2021
- Conductivity, cloud point and molecular dynamics investigations of the interaction of surfactants with ciprofloxacin hydrochloride drug: Effect of electrolytes
Journal of Molecular Liquids · 2020
- Cysteine focused covalent inhibitors against the main protease of SARS-CoV-2
Journal of Biomolecular Structure and Dynamics · 2020
- Investigation of the impacts of temperature and electrolyte on the interaction of cationic surfactant with promethazine hydrochloride: Combined conductivity and molecular dynamics studies
Journal of Molecular Liquids · 2020
- Conductometric and molecular dynamics studies of the aggregation behavior of sodium dodecyl sulfate (SDS) and cetyltrimethylammonium bromide (CTAB) in aqueous and electrolytes solution
Journal of Molecular Liquids · 2019
- Influence of alcohols/electrolytes on the interaction of reactive red dye with surfactant and removal of dye from solutions
Journal of environmental chemical engineering · 2019
- Aggregation behavior of cetyldimethylethylammonium bromide under the influence of bovine serum albumin in aqueous/electrolyte solutions at various temperatures and compositions: conductivity and molecular dynamics study
RSC Advances · 2019
- Mutation Spectrum in TPO Gene of Bangladeshi Patients with Thyroid Dyshormonogenesis and Analysis of the Effects of Different Mutations on the Structural Features and Functions of TPO Protein through<i> In Silico</i> Approach
BioMed Research International · 2019
- Solvent effect on vibrational circular dichroism of chiral amino acids
Theoretical Chemistry Accounts · 2019
- Journal of Molecular Liquids×3
- Bioconjugate Chemistry×2
- Journal of environmental chemical engineering×1
- Journal of Biomolecular Structure and Dynamics×1
- Journal of Materials Chemistry B×1
- Anton V. Sinitskiy
Computer Science · Purdue University West Lafayette
- A. M. Wasserman
Biochemistry, Genetics and Molecular Biology · The Ohio State University
- Abayomi Emmanuel Adegboyega
Computer Science · Purdue University West Lafayette
- Abhik Seal
Computer Science · Indiana University
- Armen G. Beck
Computer Science · Purdue University West Lafayette
This profile was generated automatically from public scholarly data (OpenAlex). Group size and activity levels are estimates derived from co-authorship patterns.
Last updated Jul 20, 2026.
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