Aims & Scope

Computational Chemistry (CC) is a unique platform for publishing novel ideas, research outcomes and fundamental advances in all aspects of computational chemistry.

All manuscripts must be prepared in English and are subject to a rigorous and fair peer-review process. Generally, accepted papers will appear online within 3 weeks followed by printed hard copy. The journal publishes original papers including but not limited to the following fields:

• · Ab Initio Quantum Mechanics

• · Chemical Artificial Intelligence

• · Chemical Computer-Assisted Instruction

• · Cheminformatics

• · Chemistry Database

• · Code Benchmarking

• · Computational Analytical Chemistry

• · Computational Biochemistry

• · Computational Biophysics

• · Computational Colloidal Chemistry

• · Computational Electro-chemistry

• · Computational Nanochemistry

• · Computational Surface Chemistry

• · Computer Molecular Modeling

• · Computer-aided Drug Design

• · Data Acquisition, Statistic Analysis and Other Applications

• · Density Functional Theory

• · Force Field Development and Testing

• · Molecular Design

• · Molecular Dynamics

• · Molecular Mechanics

• · Molecular Modeling

• · Molecular Simulation

• · Molecular Structure Modeling and Image Display

• · Quantum Chemistry Calculation

• · Semi-Empirical Quantum Mechanics

• · Statistical Mechanics

• · Theoretical Inorganic Chemistry

• · Theoretical Organic Chemistry

• · Theoretical Thermo Chemistry







We are also interested in:
1) Short reports—2-5 page papers where an author can present either preliminary data or an idea with theoretical background, but has not yet completed the research needed for a complete paper;
2) Short communications—2-5 page papers; 
3) Technical notes—2-5 page papers;
4) Letters to the Editor (the number of pages is not restricted);
5) Reviews or book reviews—comments and critiques (the number of pages is not restricted);
6) Advertisement – 1-2 page papers;
7) News Letters – 1-5 page papers.