JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN

Scope & Guideline

Elevating Research Standards in Computer-Aided Molecular Design

Introduction

Immerse yourself in the scholarly insights of JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN with our comprehensive guidelines detailing its aims and scope. This page is your resource for understanding the journal's thematic priorities. Stay abreast of trending topics currently drawing significant attention and explore declining topics for a full picture of evolving interests. Our selection of highly cited topics and recent high-impact papers is curated within these guidelines to enhance your research impact.
LanguageEnglish
ISSN0920-654x
PublisherSPRINGER
Support Open AccessNo
CountryNetherlands
TypeJournal
Convergefrom 1987 to 2024
AbbreviationJ COMPUT AID MOL DES / J. Comput.-Aided Mol. Des.
Frequency12 issues/year
Time To First Decision-
Time To Acceptance-
Acceptance Rate-
Home Page-
AddressVAN GODEWIJCKSTRAAT 30, 3311 GZ DORDRECHT, NETHERLANDS

Aims and Scopes

The JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN focuses on the integration of computational techniques with molecular design in the pharmaceutical and biochemical fields. The journal aims to advance the understanding of molecular interactions and enhance drug discovery processes through innovative methodologies and technologies.
  1. Computational Drug Design and Discovery:
    The journal emphasizes the use of computational approaches for drug design, including molecular docking, QSAR modeling, and virtual screening, to identify potential drug candidates and optimize their properties.
  2. Molecular Dynamics Simulations:
    A significant focus is placed on molecular dynamics simulations to study the behavior of biomolecules and their interactions with ligands, providing insights into stability, conformational changes, and binding affinities.
  3. Machine Learning and AI in Molecular Design:
    The incorporation of machine learning and artificial intelligence techniques is a prominent theme, aimed at enhancing predictive modeling, optimizing drug properties, and accelerating the drug discovery pipeline.
  4. Structure-Based and Ligand-Based Approaches:
    The journal covers both structure-based and ligand-based methodologies, facilitating a comprehensive understanding of molecular interactions and guiding the design of new compounds.
  5. Interdisciplinary Approaches:
    Encouraging interdisciplinary research, the journal integrates insights from chemistry, biology, and computational science to address complex challenges in molecular design and drug discovery.
Recent publications in the JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN reflect a dynamic shift towards innovative methodologies and emerging themes that resonate with current trends in molecular design and drug discovery.
  1. AI-Driven Drug Discovery:
    There is a significant increase in research focused on the application of artificial intelligence and machine learning in drug discovery, particularly in optimizing molecular properties and enhancing predictive accuracy.
  2. Integration of Quantum Mechanics with Molecular Simulations:
    Emerging studies are increasingly integrating quantum mechanical approaches with molecular dynamics simulations, offering deeper insights into molecular interactions and improving the accuracy of binding affinity predictions.
  3. High-Throughput Virtual Screening:
    The trend towards high-throughput virtual screening methods is gaining momentum, enabling the rapid assessment of large compound libraries and facilitating faster identification of potential drug candidates.
  4. Multi-Parameter Optimization in Drug Design:
    Recent papers highlight the growing importance of multi-parameter optimization frameworks that consider various physicochemical and biological properties simultaneously to streamline the drug design process.
  5. Data-Driven Approaches in Computational Chemistry:
    The use of data-driven methodologies, including deep learning and ensemble methods, is on the rise, showcasing their potential for improving the efficiency and accuracy of molecular modeling and predictions.

Declining or Waning

While the JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN has seen a robust focus on various computational methodologies, certain themes appear to be losing traction or becoming less prominent in recent publications.
  1. Traditional QSAR Models:
    Although quantitative structure-activity relationship (QSAR) modeling remains important, there is a noticeable decline in the emphasis on traditional QSAR techniques, likely due to the increasing adoption of machine learning methods that offer more sophisticated predictive capabilities.
  2. Basic Molecular Docking Techniques:
    The frequency of publications focusing solely on conventional molecular docking without incorporating advanced methodologies or machine learning enhancements has decreased, suggesting a shift towards more integrated and complex approaches.
  3. In Vitro Validation Studies:
    There seems to be a waning interest in standalone in vitro validation studies without a strong computational component, as the field increasingly values integrated computational-experimental workflows.
  4. Exploratory Data Analysis in Drug Discovery:
    While exploratory data analysis remains crucial, its standalone presence in publications has diminished, overshadowed by more focused studies employing advanced modeling and simulation techniques.

Similar Journals

Computational and Theoretical Chemistry

Bridging Disciplines for a Sustainable Scientific Future
Publisher: ELSEVIERISSN: 2210-271XFrequency: 12 issues/year

Computational and Theoretical Chemistry, published by ELSEVIER, stands at the forefront of interdisciplinary research in the realms of computational chemistry, theoretical physics, and biochemistry. With its ISSN 2210-271X and E-ISSN 1872-7999, the journal has established a significant presence in the academic community since its inception. Covering innovative computational methodologies and theoretical advancements, it addresses critical issues in condensed matter physics and molecular biochemistry, providing a rich resource for scholars and industry professionals alike. The journal enjoys a respectable impact factor and ranks notably in several Scopus categories, making it a vital platform for disseminating high-quality research. It adopts an open-access model, facilitating wider readership and engagement, which is essential for fostering collaborative innovations in the scientific landscape. As it continues to evolve from 2011 to 2024, Computational and Theoretical Chemistry is committed to advancing knowledge and promoting insightful discussions within the scientific community.

Current Computer-Aided Drug Design

Pioneering Computational Strategies for Effective Drug Design
Publisher: BENTHAM SCIENCE PUBL LTDISSN: 1573-4099Frequency: 4 issues/year

Current Computer-Aided Drug Design, published by BENTHAM SCIENCE PUBL LTD, is a pivotal journal dedicated to the integration of computer-aided methodologies within the drug design process. With its ISSN 1573-4099 and E-ISSN 1875-6697, this journal serves as a vital resource for researchers, professionals, and students interested in advancing the fields of pharmacology and molecular medicine. Operating under a framework that spans from 2006 to 2024, it aims to foster innovative approaches and discussions surrounding drug design strategies, computational techniques, and the therapeutic potential of novel compounds. Although it currently holds a Q4 rating in Drug Discovery and Molecular Medicine as well as a Q3 in Medicine (miscellaneous) within the 2023 category quartiles, the journal continues to enhance its visibility and relevance in the academic community. Its Scopus rankings reflect its commitment to quality research, positioning it in the context of drug discovery and molecular studies. As the field of drug design evolves, Current Computer-Aided Drug Design remains an essential platform for disseminating cutting-edge findings and facilitating collaboration among specialists aiming for significant advancements in drug development.

MOLECULAR DIVERSITY

Catalyzing Discoveries in Drug Development and Beyond
Publisher: SPRINGERISSN: 1381-1991Frequency: 4 issues/year

MOLECULAR DIVERSITY, published by Springer, stands as a pivotal platform within the fields of chemistry, biology, and pharmacology since its inception in 1995. This esteemed journal aims to foster interdisciplinary research and innovation, particularly in areas such as catalysis, drug discovery, inorganic and organic chemistry, and molecular biology. With a diverse scope that reflects contemporary scientific challenges, it has been recognized for its significant contributions, boasting commendable Scopus rankings and an impact factor that underscores its relevance in critical fields. Although not an open access journal, MOLECULAR DIVERSITY continues to influence and engage researchers, professionals, and students alike by providing a forum for high-quality peer-reviewed articles and cutting-edge research findings. As it converges years of scientific dynamism from 1995 to 2024, this journal remains vital for those advancing the frontiers of molecular science and engineering.

Journal of Computational Biophysics and Chemistry

Innovating Computational Techniques for Biochemical Breakthroughs
Publisher: WORLD SCIENTIFIC PUBL CO PTE LTDISSN: 2737-4165Frequency: 8 issues/year

The Journal of Computational Biophysics and Chemistry, published by World Scientific Publishing Co. Pte Ltd, is a distinguished platform dedicated to advancing the fields of biophysics and computational chemistry. With an ISSN of 2737-4165 and an E-ISSN of 2737-4173, this journal has garnered attention since its inception, earning a Q3 ranking in Computational Theory and Mathematics and Q4 rankings in both Computer Science Applications and Physical and Theoretical Chemistry as of 2023. The scope of the journal encompasses innovative research that integrates computational techniques with biochemical applications, making it essential reading for researchers, professionals, and students alike. With open access options available, the journal ensures that cutting-edge findings are easily accessible to a global audience, thereby fostering collaboration and innovation in the scientific community. Based in Singapore, the journal aims to converge ideas and methodologies from 2021 to 2024, paving the way for transformative insights in computational methods. Join a community at the forefront of research and applications that bridge disciplines through rigorous scholarship and pioneering discoveries.

Molecular Informatics

Bridging Computational Techniques with Biological Innovation
Publisher: WILEY-V C H VERLAG GMBHISSN: 1868-1743Frequency: 12 issues/year

Molecular Informatics is a prestigious journal published by WILEY-V C H VERLAG GMBH, dedicated to advancing the fields of computational analysis and molecular modeling. As a key resource in the realms of Computer Science Applications, Drug Discovery, Molecular Medicine, Organic Chemistry, and Structural Biology, this journal is recognized for its significant contributions and is ranked in the Q2 and Q3 categories across multiple disciplines, positioning it among the leading journals for researchers and academics. With an impressive track record since its inception in 2010 and converging its contributions until 2024, Molecular Informatics aims to bridge the gap between computational techniques and biological applications, promoting interdisciplinary collaboration and innovation. Accessible to a global audience, the journal reflects a commitment to advancing science through open access options, making cutting-edge research available to students, professionals, and decision-makers alike. This journal serves as an indispensable platform for disseminating high-quality research and fostering the development of new theoretical and practical frameworks in molecular informatics.

JOURNAL OF MOLECULAR GRAPHICS & MODELLING

Transforming Research with Cutting-edge Modeling Techniques
Publisher: ELSEVIER SCIENCE INCISSN: 1093-3263Frequency: 6 issues/year

JOURNAL OF MOLECULAR GRAPHICS & MODELLING, published by Elsevier Science Inc, is a leading peer-reviewed journal dedicated to the fields of molecular graphics and modeling. With an ISSN of 1093-3263 and an E-ISSN of 1873-4243, this journal has established its relevance since its inception in 1997, and continues to thrive as it extends its scope into 2024. Acknowledged for its impact in the academic community, it holds a Q2 ranking in both Computer Graphics and Computer-Aided Design and Materials Chemistry, as well as a Q3 ranking in Physical and Theoretical Chemistry and Spectroscopy, reflecting its significance across multidisciplinary research domains. Notably, the journal ranks in the 73rd percentile for Computer Graphics and maintains competitive standings in Materials Science and Chemistry areas. Although it does not currently offer open access options, the journal is an essential resource for researchers, professionals, and students who are engaged in cutting-edge studies and applications in molecular graphics, computational methods, and material design. By facilitating a deeper understanding of molecular interactions through innovative graphical modeling, the journal contributes significantly to advancements in science and technology.

COMPUTERS IN BIOLOGY AND MEDICINE

Transforming Healthcare Through Cutting-Edge Computer Science
Publisher: PERGAMON-ELSEVIER SCIENCE LTDISSN: 0010-4825Frequency: 16 issues/year

COMPUTERS IN BIOLOGY AND MEDICINE is a prestigious academic journal published by Pergamon-Elsevier Science Ltd, dedicated to advancing the fields of Computer Science Applications and Health Informatics. With an impressive impact factor and ranking within the Q1 quartile for both categories, this journal plays a crucial role in disseminating high-quality research findings that influence cutting-edge developments at the intersection of computing and healthcare. Covering a broad range of topics from computational biology to medical informatics, it serves as a vital resource for researchers, professionals, and students striving to harness technology for medical advancements. The journal has been publishing since 1970 and continues to evolve, incorporating the latest trends and innovations in the field, thereby ensuring that it remains a key contributor to scientific inquiry and knowledge. With accessible content and a global reach, COMPUTERS IN BIOLOGY AND MEDICINE invites submissions that elevate the understanding and application of computational methods in biological and medical contexts.

JOURNAL OF MOLECULAR RECOGNITION

Pioneering Research in Biochemical Interactions
Publisher: WILEYISSN: 0952-3499Frequency: 12 issues/year

JOURNAL OF MOLECULAR RECOGNITION, published by Wiley, is an esteemed academic journal that has been at the forefront of molecular biology and structural biology research since its inception in 1988. With its ISSN 0952-3499 and E-ISSN 1099-1352, this journal serves as a vital platform for disseminating innovative studies and findings in the realms of biochemical interactions and molecular structure elucidation. Although currently positioned in Quartile 4 of both molecular and structural biology categories based on 2023 metrics, the journal is dedicated to advancing knowledge in quantitative and qualitative molecular recognition processes. Researchers, professionals, and students alike will find that this journal is instrumental in keeping abreast of cutting-edge developments in the field, even as it continues to build its impact and reputation within the dynamic research landscape. Located in the United Kingdom, it is committed to promoting a diverse range of studies that drive forward the understanding of molecular interaction phenomena, thus empowering its readership to contribute effectively to the field.

JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS

Bridging the Gap Between Structure and Function in Biology
Publisher: TAYLOR & FRANCIS INCISSN: 0739-1102Frequency: 18 issues/year

JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS, published by TAYLOR & FRANCIS INC, serves as a pivotal platform for the dissemination of original research in the fields of biochemistry, molecular biology, and structural biology. With an ISSN of 0739-1102 and an E-ISSN of 1538-0254, this esteemed journal has garnered attention for its rigorous peer-review process and commitment to high-quality scientific inquiry since its inception in 1981. Ranking in the Q2 quartile for miscellaneous medicine and the Q3 quartile for both molecular and structural biology, it consistently demonstrates a significant impact within its specialties, evidenced by a high Scopus ranking. Researchers, professionals, and students are encouraged to engage with cutting-edge studies addressing the complex interactions and dynamics of biomolecules, making this journal a vital resource for advancing knowledge in the biological sciences. Although it does not offer open access options, its valuable contributions are vital for the ongoing discourse within the scientific community.

CURRENT MEDICINAL CHEMISTRY

Driving Progress in Chemical and Pharmaceutical Research.
Publisher: BENTHAM SCIENCE PUBL LTDISSN: 0929-8673Frequency: 42 issues/year

Current Medicinal Chemistry is a leading journal published by Bentham Science Publishers Ltd, known for its rigorous focus on the multifaceted realm of medicinal chemistry. With an ISSN of 0929-8673 and E-ISSN 1875-533X, the journal plays a crucial role in disseminating high-quality research findings that bridge the gap between chemistry and health sciences. Operating from Sharjah, United Arab Emirates, it has been a prominent scholarly resource since its inception in 1994, and is expected to continue until 2024. Current Medicinal Chemistry has earned its place in the academic community with an impressive impact factor and categorization in Q1 and Q2 quartiles across various disciplines, including Organic Chemistry, Biochemistry, Drug Discovery, and Pharmacology, highlighting its substantial contribution to these fields. Notably, it ranks 24th in Organic Chemistry and is within the 88th percentile, underscoring its appeal to researchers, professionals, and students alike who are keen on exploring cutting-edge advancements in drug design and development. Although it is not an open-access journal, it provides vital content that informs and inspires innovation in medicinal chemistry, appealing to a global audience committed to enhancing human health through scientific discovery.