Wolfgang Quapp | Theoretical Chemistry | Best Researcher Award

Dr. Wolfgang Quapp | Theoretical Chemistry | Best Researcher Award

Leipzig University, Germany

👨‍🎓Profiles

🎓 Early Academic Pursuits

He was born on August 23, 1947, in Waltersdorf near Greiz in Thüringen, Germany. His academic journey began in 1966 at the Universität Leipzig, where he pursued a rigorous course in mathematics, culminating in 1973. His doctoral work, completed in 1982, focused on the singular initial value problem of the Euler-Poisson-Darboux equation, investigating the continuity of solution operators and their mathematical properties—a topic reflecting a deep engagement with applied mathematical physics.

🧪 Professional Endeavors

Dr. Quapp’s professional career spanned nearly four decades at Universität Leipzig, where he served from 1973 until his retirement in 2012. Despite a temporary hiatus due to an 18-month military service between 1973 and 1975, he remained an integral figure in Leipzig’s academic and research landscape. His career included international academic collaborations, including guest positions at prestigious institutions such as VIK Dubna near Moscow and the University of Leningrad under Prof. Dr. A.A. Kiselev, as well as with Prof. Dr. M. Winnewisser in Gießen.

🔬 Contributions and Research Focus

Dr. Quapp’s research is renowned for bridging mathematics and theoretical chemistry. His work delves into mathematical methods in theoretical chemistry, quantum chemistry, and molecular physics. A significant focus has been the analysis of potential energy surfaces, valley-ridge inflection points, and reaction path bifurcations—critical to understanding molecular mechanisms and chemical reactions. Since 2010, he has collaborated extensively with Prof. Dr. J.M. Bofill in Barcelona, contributing to the intersection of chemical reaction theory and differential geometry.

🌍 Impact and Influence

By 2024, Dr. Quapp had authored over 120 scientific publications, presented 75 talks or posters, and conducted 190 peer reviews for 70 esteemed journals, underlining his influence as both a thought leader and a dedicated academic community contributor. His insights have shaped modern understanding in computational chemistry and mathematical modeling of complex chemical systems.

📚 Academic Cites and Recognition

Dr. Quapp is a respected member of several scholarly bodies, including the Leibniz-Sozietät Berlin, the Deutsche Mathematiker-Vereinigung, the Deutsche Bunsengesellschaft für Physikalische Chemie, and the Ostwald-Gesellschaft. These memberships reflect his stature in both the mathematical and physical chemistry communities. His works are widely cited, and his academic website catalogues his prolific output: List of Activities.

🧰 Technical Skills

Possessing strong analytical and computational skills, Dr. Quapp has contributed to solving nonlinear partial differential equations, the geometric theory of dynamical systems, and computational modeling in chemistry. His ability to apply high-level mathematical techniques to chemical problems highlights his interdisciplinary mastery.

👨‍🏫 Teaching Experience

During his tenure at Universität Leipzig, Dr. Quapp was not only a researcher but also a mentor and educator, guiding generations of students in the complex interplay between mathematics and chemistry. His teaching helped bridge disciplinary boundaries and inspire future scholars to pursue rigorous theoretical investigations.

🏆 Legacy and Future Contributions

Though formally retired since 2012, Dr. Quapp continues to collaborate internationally and publish influential work. His legacy is one of cross-disciplinary innovation, scholarly rigor, and mentorship. His ongoing collaboration with researchers like Prof. Bofill ensures that his work will continue to influence the fields of quantum chemistry and mathematical modeling for years to come.

📖Notable Publications

Comment to: “Topology of molecular deformations induces triphasic catch bonding in selectin–ligand bonds”
Authors: W Quapp, J.M. Bofill
Journal: bioRxiv, Preprint ID 2024.08.21.608529
Year: 2024

Shaping Reactions: The Exciting World of Mechanochemistry and Molecular Interactions
Authors: W Quapp, J.M. Bofill
Year: 2024

Altering Selectivity in the Tug-of-War Mechanism by Mechanochemistry – with an Explanation of Catch Bond Behavior
Authors: W Quapp, J.M. Bofill
Journal: Foundations, Volume 1, Pages 1–26
Year: 2023

An algorithm to find the optimal oriented external electrostatic field for annihilating a reaction barrier in a polarizable molecular system
Authors: J.M. Bofill i Villà, M. Severi, W. Quapp, J. Ribas Ariño, I.P.R. Moreira, and others
Journal: Journal of Chemical Physics, Volume 159, Pages 1–19
Year: 2023

Nasarul Islam | Computational Chemistry | Best Researcher Award

Assist. Prof. Dr. Nasarul Islam | Computational Chemistry | Best Researcher Award

HKM Degree College Bandipora, India

👨‍🎓Profiles

🏫 Early Academic Pursuits

He embarked on his academic journey with a passion for Theoretical Inorganic and Organic Chemistry. His research during his Ph.D. focused on developing OLED and nonlinear device materials using computational methods. He delved into the electronic structure and spectral properties of chiro-optic systems and explored structure-property relationships for materials with applications in optical, magnetic, and electrical domains. These foundational experiences shaped his expertise in theoretical chemistry and material design.

💼 Professional Endeavors

He serves as an Assistant Professor in the Department of Chemistry at HKM-Govt. Degree College, Bandipora, J&K, India, since April 11, 2017. Alongside his teaching duties, he is an Academic Counsellor for Indira Gandhi National Open University (IGNOU). His collaborative work extends to notable institutions, including the National Institute of Technology, Jalandhar, where he investigates reaction mechanisms and molecular dynamics of ionic liquids in collaboration with Dr. Vikramjeet Singh.  Previously, Dr. Islam contributed significantly to research under the mentorship of Prof. (Dr.) S. S. Chimni at Guru Nanak Dev University, Amritsar. His work focused on enantioselective product formation from organocatalyzed processes and transition-state mechanisms.

🔬 Contributions and Research Focus

His research interests are rooted in computational chemistry. He employs quantum mechanical methods to design and investigate materials for energy storage and conversion, OLED devices, and transport systems. His work bridges theoretical models and practical applications, synthesizing theoretically designed charge transport materials for experimental validation. His focus spans: The electronic and optical properties of chiro-optic systems, Energy storage and conversion materials, Quantum mechanical studies on molecular dynamics and ionic liquids.

🌟 Impact and Influence

His contributions have earned him international recognition. He is an MRSC fellow of the Royal Society of Chemistry, UK, and has been acknowledged with numerous awards, including: The DSK Postdoctoral Fellowship (UGC-India), Recognition for outstanding contributions in reviewing from Spectrochimica Acta Part A, Multiple awards for oral and poster presentations at conferences. He also serves on the editorial boards of Frontiers in Applied Chemistry and the Journal of Computational Chemistry & Molecular Modelling, influencing research dissemination in his field.

📚 Academic Citations and Publications

He has an extensive portfolio of research publications cited globally. His work on OLED materials and ionic liquids is highly regarded, reflecting his impact in theoretical and applied chemistry.

🛠️ Technical Skills

He is proficient in a variety of computational and analytical techniques, including: Quantum mechanical modeling, Molecular dynamics simulations, Spectral analysis and transport property evaluation.

👩‍🏫 Teaching and Mentorship

As an educator, He is committed to advancing chemical education. His teaching philosophy integrates research with pedagogy, inspiring students to explore complex chemical systems. His guidance extends to research projects and academic counseling, fostering a culture of scientific curiosity.

🌍 Legacy and Future Contributions

His legacy lies in bridging computational insights with real-world applications, particularly in energy systems and material design. Moving forward, he aims to expand his research on sustainable materials and enhance collaborations to address global challenges in energy and materials science.

🌟 Key Highlights

His work stands as a testament to his dedication to advancing computational chemistry, fostering innovation, and mentoring the next generation of scientists. His endeavors reflect a balanced blend of theoretical exploration, practical synthesis, and impactful teaching.

📖Notable Publications

Advancements in ionic liquid-based corrosion inhibitors for sustainable protection strategies: from experimental to computational insights

Authors: Kumar, P.; Holmberg, K.; Soni, I.; Sillanpää, M.; Chauhan, V.
Journal: Advances in Colloid and Interface Science
Year: 2024

Quantitative structure-activity relationship and ADME prediction studies on series of spirooxindoles derivatives for anti-cancer activity against colon cancer cell line HCT-116

Authors: Kaur, S.; Kaur, J.; Zarger, B.A.; Islam, N.; Mir, N.
Journal: Heliyon
Year: 2024

Unveiling the potential of NiFe layered double hydroxide (LDH)/CuWO4 S-scheme heterojunction for sulfamethoxazole photodegradation and nitrobenzene photoreduction to aniline

Authors: Sharma, R.; Sambyal, S.; Mandyal, P.; Chauhan, V.; Shandilya, P.
Journal: Journal of Environmental Chemical Engineering
Year: 2024

Fabrication of dual S-scheme based CuWO4/NiFe/WO3 heterojunction for visible-light-induced degradation and reduction applications

Authors: Sharma, R.; Islam, N.; Priye, A.; Chauhan, V.; Shandilya, P.
Journal: Journal of Environmental Chemical Engineering
Year: 2024

Cu2O/WO3: A promising S-scheme heterojunction for photocatalyzed degradation of carbamazepine and reduction of nitrobenzene

Authors: Mandyal, P.; Sharma, R.; Sambyal, S.; Chauhan, V.; Shandilya, P.
Journal: Journal of Water Process Engineering
Year: 2024

An Updated Overview on the Synthesis and Anticancer Evaluation of Quinazoline Derivatives

Authors: Kaur, J.; Kaur, S.; Anand, A.; Singh, S.; Singh, A.
Journal: ChemistrySelect
Year: 2023