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REHIN SULAY

@rehinsulay

Computational chemist at Southern Methodist University who investigated atmospheric pollutant reactions and published computational chemistry research.

At Southern Methodist University, I worked as a Postdoctoral Research Associate, applying computational chemistry to investigate chemical systems. My research has included mechanistic modeling of atmospheric pollutant reactions and studies of molecular interactions.

I use quantum chemical methods, DFT, and molecular dynamics simulations, alongside tools such as Gaussian, VASP, and Python. My publications also explore drug discovery approaches, catalysis, and sustainable materials.

Experience

Work history, roles, and key accomplishments

SU

Postdoctoral Research Associate

Southern Methodist University

Jan 2023 - Jan 2025 (2 years)

Conducted postdoctoral research in computational chemistry, focusing on molecular modeling, reaction mechanisms, and AI-driven drug discovery.

Molecular Modeling Reaction Mechanisms AI Drug Discovery Quantum Chemistry Molecular Dynamics DFT Gaussian VASP Quantum ESPRESSO Orca NWChem Python C++Machine Learning LBDD SBDD Molecular Docking Pharmacophores Virtual Screening

Education

Degrees, certifications, and relevant coursework

SU

Southern Methodist University

Postdoctoral Research, Chemistry

2023 - 2025

Postdoctoral research in computational chemistry, focusing on molecular modeling and AI-driven drug discovery.

MU

Mahatma Gandhi University

Doctor of Philosophy, Chemistry

2019 - 2023

Doctor of Philosophy in Chemistry. Thesis on quantum chemical investigation of atmospheric nitrogenous pollutants.

MU

Mahatma Gandhi University

Master of Science, Chemistry

Grade: 8.13/10.00

Master of Science in Chemistry with a CGPA of 8.13/10.00.

MU

Mahatma Gandhi University

Bachelor of Science, Chemistry

Grade: 3.61/4.00

Bachelor of Science in Chemistry with a CGPA of 3.61/4.00.

Tech stack

Software and tools used professionally

Python

C++

Availability

Looking for a job

Location

India

Authorized to work in

Salary expectations

140k+ INR

Job categories

Computational Chemist

Skills

Computational Chemistry Quantum Chemistry DFT Ab Initio Reaction Mechanism Prediction Transition State Prediction Molecular Dynamics QM MM Calculations Solvation Electronic Structure Ligand Based Design Structure Based Virtual Screening Molecular Docking Pharmacophores Virtual Screening

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