International Journal of Quantitative Structure-Property Relationships (IJQSPR): 2379-7487, 2379-7479: Medicine & Healthcare Journals


The International Journal of Quantitative Structure-Property Relationships (IJQSPR) is a new journal that will explore the latest research surrounding the topic of Quantitative Structure-Property Relationship (QSPR) models and the applications of these models across the fields of materials science, chemical engineering, pharmaceutical and medicinal chemistry, pharmacokinetics, toxicology (including ecotoxicology), and agricultural sciences, among others. The cross-disciplinary applications of QSPR models featured within IJQSPR make this journal an ideal reference source for chemists, researchers, professionals, engineers, and graduate-level students across industries.

Effective from Volume 6, the Journal also welcomes research on application of chemometric methods and machine learning algorithms in analyzing chemical, biological, toxicity, property and omics data.

Topics Covered

  • Applications of chemometric methods in analyzing complex data
  • Applications of machine learning algorithms in analyzing complex data
  • Biological applications
  • Chemical applications
  • Chemical Properties
  • Chemometric modeling
  • Development of new descriptors and/or validation metrics
  • Drug design applications
  • Environmental fate modeling
  • Material property modeling
  • Molecular Modeling
  • New software development of QSAR/QSPR applications
  • Physicochemical properties
  • Predictive toxicology
  • Property modeling
  • Risk management applications

Mission and Scope

The mission of the International Journal of Quantitative Structure-Property Relationships (IJQSPR) is to present double-blind peer-reviewed research articles on all facets of Quantitative Structure-Property Relationship (QSPR) models and applications. In presenting key research in the field of chemical research, IJQSPR aims to advance the current literature available across various chemistry disciplines and serve as a foundation upon which future research on QSPR can evolve.

Table of Contents and List of Contributors

Volume 6: 4 Issues (2021): 1 Released, 3 Forthcoming

Volume 5: 4 Issues (2020)

Volume 4: 4 Issues (2019)

Volume 3: 2 Issues (2018)

Volume 2: 2 Issues (2017)

Volume 1: 2 Issues (2016)

View Complete Journal Contents Listing


Editor(s)-in-Chief Biography

Dr. Kunal Roy is a Professor in the Department of Pharmaceutical Technology, Jadavpur University, Kolkata, India. He has been a recipient of Commonwealth Academic Staff Fellowship (University of Manchester, 2007) and Marie Curie International Incoming Fellowship (University of Manchester, 2013). The field of his research interest is QSAR and Molecular Modeling with application in Drug Design and Ecotoxicological Modeling. Dr. Roy has published more than 300 research articles in refereed journals (current SCOPUS h index 43). He has also coauthored two QSAR related books, edited five QSAR books and published more than ten book chapters. Dr. Roy is the Co-Editor-in-Chief of Molecular Diversity (Springer Nature) and Editor-in-Chief of International Journal of Quantitative Structure-Property Relationships (IGI Global). Dr. Roy serves in different capacities in the Editorial Boards of several International Journals.

Editorial Board

Associate Editors
Agnieszka Gajewicz-Skretna, University of Gdansk
Chanin Nantasenamat, Mahidol University, Thailand
Chia Ming Chang, National Chung Hsing University, Taiwan
Georgia Melagraki, NovaMechanics Ltd, Cyprus
Orazio Nicolotti, University of Bari, Italy
Pravin Ambure, ProtoQSAR SL, Spain
Stephen Barigye, Federal University of Lavras, Brazil
Supratik Kar, Jackson State University, United States
Editorial Review Board
Adriano Andricopulo, Brazilian Chemical Society, Brazil
Alejandro Speck, Russian Federation
Aleksandar Veselinovic, University of Niš, Faculty of Medicine, Serbia
Andrey Toropov, Mario Negri Institute for Pharmacological Research, Italy
Angelo Carotti, University of Bari, Italy
Anna Tsantili-Kakoulidou, National and Kapodistrian University of Athens, Greece
Antreas Afantitis, NovaMechanics Ltd, Cyprus
Asim Debnath, Lindsley F. Kimball Research Institute, United States
Bakhtiyor Rasulev, North Dakota State University, United States
Bono Lucic, Rugjer Bošković Institute, Croatia
David Winkler, Monash University, Australia
Eduardo de Melo, Universidade Estadual do Oeste do Paraná, Brazil
Emili Besalu, University of Girona, Spain
Esin Aki-Yalcin, Ankara University, Turkey
Evans Coutinho, Bombay College of Pharmacy, India
Feng Luan, Yantai University, China
Giuseppina Gini, Politecnico di Milano, Italy
Haralambos Sarimveis, National Technical University of Athens, Greece
Humberto Gonzalez-Diaz, University of the Basque Country, Spain
Jahan Ghasemi, University of Tehran, Iran, Islamic Republic Of
Jerzy Leszczynski, Jackson State University, United States
John Dearden, Liverpool John Moores University, United Kingdom, United Kingdom
Jorge Gálvez, University of Valencia, Spain
Karoly Heberger, Research Centre for Natural Sciences, Hungarian Academy of Sciences, Hungary
Lemont Kier, Virginia Commonwealth University, United States
Luciana Scotti, Federal University of Paraiba, Brazil
M H Fatemi, University of Mazandaran, Iran
M. Natália Cordeiro, University of Porto, Portugal
Mange Yadav, Maharaja Sayajirao University of Baroda, India
Márcia Ferreira, Instituto de Química – UNICAMP, Brazil
Marjana Novič, National Institute of Chemistry, Slovenia
Matheus de Freitas, Federal University of Lavras, Brazil
Maykel Cruz-Monteagudo, Universidad de Las Américas – Quito, Ecuador
Michael Wiese, University of Bonn, Germany
Nenad Trinajstic, Ruđer Bošković Institute, Croatia
Pablo Duchowicz, Instituto de Investigaciones Fisicoquímicas Teóricas y Aplicadas, Argentina
Rafael Gozalbes, ProtoQSAR SL, Universidad de Valencia (PCUV), Spain
Ramon Carbo-Dorca, University of Girona, Spain
Satya Gupta, National Institute of Technical Teachers’ Training & Research, India
Tomasz Puzyn, University of Gdansk, Poland
Victor Kuz’min, A.V. Bogatsky Phys.-Chem. Institute, National Academy of Science, Ukraine
Vladimir Poroikov, Institute of Biomedical Chemistry, Russia
William Acree, University of North Texas, United States


Prospective authors should note that only original and previously unpublished article manuscripts will be considered. Interested authors must consult the Journal Guidelines for Manuscript Submission at PRIOR to submission. Any further questions may be answered at All article manuscript submissions will be forwarded to at least three members of the editorial review board of the journal for a double-blind peer review. The final decision regarding acceptance/revision/rejection will be based on the reviews received from the reviewers.

All inquiries should be directed to the attention of:

Dr. Kunal Roy

Editor in Chief

International Journal of Quantitative Structure-Property Relationships (IJQSPR) (


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