プロフィール詳細

プロジェクトを作成

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Dr. Bouabbaci H.に依頼

Algeria

Computational Chemist | DFT, Molecular Modeling & Drug Design Specialist

プロフィール概要

I am a computational chemist with a PhD in theoretical and computational chemistry. I specialize in density functional theory (DFT), molecular modeling, and quantum chemical simulations using Gaussian and related software. My research experience includes studying electronic structure, optical properties, and reaction mechanisms of molecular systems. I have worked on modeling and analyzing chemical and material systems using advanced computational methods. My interests include drug design, materials modeling, and theoretical investigation of molecular properties.

専門分野

• ☆ Molecular Modeling
• ☆ Quantum Chemistry
• ☆ Computational Chemistry
• ☆ Optics
• ☆ LaTex
• ☆ Drug Discovery
• ☆ Drug Design

サービス

• Writing

Writing Technical Writing

職務経験

Industrial scientific Researcher / Project coordinator

Valencia University

2月 2023 - 現在

学歴

Ph.D

Higher Normal School of Technology Education ENSET Skikda

7月 2025 - 現在

認定資格

• Computational Chemistry Training

  University / Research Lab

  9月 2019 - 7月 2025

出版物

JOURNAL ARTICLE

Bouabbaci Hayet (2025). A MEDT investigation of mechanism and selectivities of the intramolecular [3+2] cycloaddition reaction of (E)-N-((2-((methylbut-2-en-1-yl)thio)-1H-indol-3-yl)methylene)methanamine-oxide.

Hayet Bouabbaci, Abdelmalek Khorief Nacereddine (2025). Effect of electronic nature of substituent position on the linear and nonlinear optical and physical properties of some quinoline derivatives. A computational study . Molecular Physics.