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Journal of Computational Chemistry

Journal of Computational Chemistry

Edited By:Charles L. Brooks III, Masahiro Ehara, Gernot Frenking, and Peter R. Schreiner

Vol 39(32 Issues in 2018 ) Print ISSN: 0192-8651 Online ISSN: 1096987X Impact Factor: 3.194



This distinguished journal publishes articles concerned with all aspects of computational chemistry: analytical, biological, inorganic, organic, physical, and materials. The Journal of Computational Chemistry presents original research, contemporary developments in theory and methodology, and state-of-the-art applications. Computational areas that are featured in the journal include ab initio and semiempirical quantum mechanics, density functional theory, molecular mechanics, molecular dynamics, statistical mechanics, cheminformatics, biomolecular structure prediction, molecular design, and bioinformatics.