Journal of Chemical Theory and Computation Impact Factor, Quartile, Indexing, Ranking

Journal of Chemical Theory and Computation (JCoC) is a scholarly journal dedicated to publishing research in the field of Computer Science, and Published by American Chemical Society. The Print-ISSN of Journal of Chemical Theory and Computation is 1549-9618 and its abbreviation is J Chem Theory Comput.

The Publicaiton fees (APC) is $4,500.

The Journal of Chemical Theory and Computation is a bi-weekly peer-reviewed journal that publishes papers on new theories, methodology in quantum electronic structure, molecular dynamics, and statistical mechanics and/or their important applications.

Specific topics include but are not limited to:

• Advances in ab initio quantum mechanics, density functional theory
• Molecular dynamics and Monte Carlo simulations
• Ab initio dynamics for chemical reactions
• Solvation models
• QM/MM methods for complex chemical processes
• New theories for quantum computers and their chemical applications
• Artificial Intelligence, machine learning, data science for chemical theory and computation
• Computational chemistry packages that present innovative methods
• Design and properties of new materials and bio-molecular systems
• Novel theories and applications in surface science
• Biomolecular dynamics for protein folding/phase separation

The Journal welcomes submissions that include advances in theory, methodology, and data science with applications to compelling problems in chemistry and materials science. The Journal does not consider papers on the following topics:

• Straightforward applications on only single-class systems of well-established methods, including DFT, traditional wave function theories, and molecular dynamics.

• Journal Website
• PubMed
• Scopus
• SCImago