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MolModSim Connect

Editorial Board

Affiliation:
Department of Chemistry, UM Centre of Excellence for Quantum Information Science and Technology (UMQIST), Faculty of Science,
University of Malaya
Kuala Lumpur, Malaysia,

Biography:

Assoc. Prof. Dr. Vannajan Sanghiran Lee is a renowned researcher specializing in molecular modeling and simulations, dedicated to advancing sustainable development goals (SDGs). With a BSc in Chemistry from Chiang Mai University, Thailand (1994), and a PhD in Pharmaceutical Sciences and Physical Chemistry from the University of Missouri-Kansas City, USA (2001) supported by a prestigious scholarship from the Institute of Promotion and Development Science and Technology Project in Thailand, she has established herself as a prominent figure in her field

Dr. Lee's exceptional contributions were recently recognized with the 2023 UNESCO Woman of Influence for Science and Technology award at the 1st International Congress for the Women of Influence (ICFWI) in Tehran, Iran. Her expertise lies in molecular modeling and simulations, including Molecular Dynamics (MD), Monte Carlo Simulations (MC), and Quantum Mechanics (QM). She applies these techniques to biomolecular and material design, driving significant contributions to sustainable development

Currently serving as a respected lecturer at the Department of Chemistry, University of Malaya, and holding the position of Deputy Head of the UM Centre of Excellence for Quantum Information Science and Technology (UMQIST), Dr. Lee's dedication and expertise in molecular modeling and simulations contribute to global SDG efforts. She also empowers the next generation of scientists through MolDesign, a student company she established as a flexible partnership platform for molecular creators and innovators.

Dr. Lee's commitment to advancing scientific knowledge, nurturing innovation, and empowering molecular creators exemplifies her dedication to driving transformative change in various industries.

Interests:

Molecular Dynamics (MD), Monte Carlo Simulations (MC), and Quantum Mechanics (QM)  
Ranjit Vijayan

Regional Editor

Affiliation:
Department of Biology, College of Science
United Arab Emirates University
Al Ain
UAE

Region:
Middle East 

Interests:
Molecular dynamics simulations of biological macromolecules, Protein structure modeling, Structure based drug discovery, Cryptides and bioactive peptides, Genomics, transcriptomics, & pharmacogenomics, Genetics of inherited disorders, High-performance computing
Robert Vianello

Regional Editor

Affiliation:
Division of Organic Chemistry and Biochemistry
Ruđer Bošković Institute
Zagreb
Croatia

Region:
Southeast Europe

Interests:
Catalysis, Drug Design, Material Design, Enzymes, Supramolecular Complexes, Proton Dynamics, Neurological Diseases

Shirley W. I. Siu

Regional Editor

Affiliation:
Faculty of Applied Sciences
Macao Polytechnic University
Macao
China

Region:
Asia 

Interests:
Computational drug discovery, cheminformatics, machine learning, biomolecular simulation, and molecular mechanics force fields. 
Affiliation:
Department of Biochemistry, Faculty of Science
Chulalongkorn University
Bangkok
Thailand

Region:
Southeast Asia

Interests:
Molecular modeling on biological systems, Rotational drug design, and Drug delivery systems. 

Anand Gaurav

Section Editor

Affiliation:
School of Health Sciences and Technology
UPES
Dehradun
India

Section Title:
Ligand and structure based design of bioactive compounds

Interests:
Molecular Modeling, Drug Design, In Silico Drug Discovery, Phosphodiesterases, Molecular Docking, QSAR, Pharmacophore, Virtual Screening, Molecular Dynamics Simulations
Arry Yanuar

Section Editor

Affiliation:
Faculty of Pharmacy, Department of Pharmacy
Universitas Indonesia
Depok
Indonesia



Interests:
Computer Simulation, Peperomia, Molecular Dynamics Simulation, Medicinal Plants
Affiliation:
School of Pharmacy
Bandung Institute of Technology
Bandung
Indonesia


Interests:
Medicinal chemistry, CADD, molecular dynamics, porphyrins, virtual screening, anticancer.
Dima A. Sabbah

Section Editor

Affiliation:
College of Pharmacy
Al-Zaytoonah University of Jordan
Amman
Jordan

Section Title:
Computational Chemistry and Drug Design Approaches

Interests:
Computational Chemistry, Drug Design, Medicinal Chemistry, Organic Synthesis, Drug Discovery. 
Fatemeh Mollaamin

Section Editor

Affiliation:
Department of Biology
Faculty of Science
Kastamonu University
Kastamonu
Turkey

Interests:
Quantum Chemistry, Computational Chemistry, Materials Modelling, Molecular Simulation, Thermodynamics.


Affiliation:
Department of Chemistry, Faculty of Science 
Chiang Mai University
Chaing Mai
Thailand



Interests:
Polymer/ Material Modeling, Biocomputing and Drug Design, Model compound and characterization
 
Ranjit Thapa

Section Editor

Affiliation:
Department of Physics
SRM University-AP
Mangalagiri
India

Section Title:
Materials for Energy and Environment

Interests:
Heterogenious Catalysts, Electrocatalysts, Electrodes for Batteries, Supercapacitors, Electronic Structure Theory, DFT

Suwipa Saen-Oon

Section Editor

Affiliation:
Nostrum Biodiscovery
Barcelona
Spain



Interests:
QM and QM/MM studies of electron transfer process and enzyme catalysis mechanism, molecular simulations in biophysics process to in silico drug discovery application
Adnan Younis

Editorial Board Member

Affiliation:
Department of Physics, College of Science
United Arab Emirates University
Al Ain
United Arab Emirates 

Interests:
Functional Materials, Energy Storage and Conversion, Electronic Properties of Materials, Nanostructures, Transport Properties, Structural, morphological and optical properties of Materials, Renewable energy.




Jer-Lai Kuo

Editorial Board Member

Affiliation:
Institute of Atomic and Molecular Sciences, Academia Sinica
Taipei
Taiwan


Interests:
Structure and Properties of H-bonded Clusters, First-Principle Studies of Bulk Materials, Application of Artificial Intelligence in Material Discovery/Design, Order/Disorder Transitions in Ice.
Keat Hoe Yeoh

Editorial Board Member

Affiliation:
Jeffrey Sachs Center on Sustainable Development
Sunway University
Selangor
Malaysia 

Interests:
Atomistic modelling of surface properties for energy storage and conversion, Monte Carlo modelling of charge transport in semiconductors



Sharifuddin Mohd D. Zain

Editorial Board Member

Affiliation:
Department of Chemistry
Faculty of Science
Universiti Malaya
Kuala Lumpur
Malaysia 

Interests:
Chemical Sciences, Computational Chemistry, Cheminformatics, Chemometrics