Computational and Theoretical Chemistry : Impact Factor & More
eISSN: 1872-7999pISSN: 2210-271X
Share this on:
Aims and Scope of Computational and Theoretical Chemistry
Computational and Theoretical Chemistry is a peer-reviewed scientific journal published by Elsevier. It was established in 1985 as Journal of Molecular Structure: THEOCHEM, a spin-off of the Journal of Molecular Structure. It obtained its current name in 2011 and covers molecular structure in theoretical chemistry. Less
Key Metrics
CiteScore 
3.1
Impact Factor
< 5
SJR
Q3Biochemistry
SNIP
0.56
Recommended pre-submission checks
Powered by 
Run standard language and technical checks to improve your manuscript – before you submit
Technical Compliance
Ensure manuscript complies with standard submission guidelines.
Language Quality
Improve clarity, grammar, and academic writing style.
A comprehensive report covering all these checks awaits you.
Topics Covered on Computational and Theoretical Chemistry
Computational and Theoretical Chemistry Journal Specifications
| Overview | |
| Publisher | ELSEVIER |
| Language | English |
| Frequency | Monthly |
| General Details | |
| Language | English |
| Frequency | Monthly |
| Publication Start Year | 2011 |
| Publisher URL | Visit website |
| Website URL | Visit website |
View less
Planning to publish in Computational and Theoretical Chemistry ?
Upload your Manuscript to get
- Degree of match
- Common matching concepts
- Additional journal recommendations
Recently Published Papers in Computational and Theoretical Chemistry
Mutations remodel interaction networks in mixed Aβ(14–23) oligomers: a molecular dynamics study
- 1 Aug 2026
- Computational and Theoretical Chemistry
DFT study of the structural, electronic, and optical properties of SiAs, SiGe, and SiSn quantum dots with potential implications for nanoelectronic and sensing applications
- 1 Jul 2026
- Computational and Theoretical Chemistry
A DFT study on the structural, electronic, and catalytic properties of CuₙSnₙ (n = 2–14) clusters
- 1 Jul 2026
- Computational and Theoretical Chemistry
Triple-sodium-doped aluminum clusters: Geometric structures and electronic properties
- 1 Jul 2026
- Computational and Theoretical Chemistry
Vibrational energy level scheme of the BCH radical: A theoretical study of Renner-teller coupling
- 1 Jul 2026
- Computational and Theoretical Chemistry
Mapping the binding site of salbutamol using potential energy surfaces: revisiting the three-point interaction model
- 1 Jul 2026
- Computational and Theoretical Chemistry
Mutations remodel interaction networks in mixed Aβ(14–23) oligomers: a molecular dynamics study
- 1 Aug 2026
- Computational and Theoretical Chemistry
DFT study of the structural, electronic, and optical properties of SiAs, SiGe, and SiSn quantum dots with potential implications for nanoelectronic and sensing applications
- 1 Jul 2026
- Computational and Theoretical Chemistry
A DFT study on the structural, electronic, and catalytic properties of CuₙSnₙ (n = 2–14) clusters
- 1 Jul 2026
- Computational and Theoretical Chemistry
Triple-sodium-doped aluminum clusters: Geometric structures and electronic properties
- 1 Jul 2026
- Computational and Theoretical Chemistry
Vibrational energy level scheme of the BCH radical: A theoretical study of Renner-teller coupling
- 1 Jul 2026
- Computational and Theoretical Chemistry
Mapping the binding site of salbutamol using potential energy surfaces: revisiting the three-point interaction model
- 1 Jul 2026
- Computational and Theoretical Chemistry
FAQs on Computational and Theoretical Chemistry
How long has Computational and Theoretical Chemistry been actively publishing? 
What is the publishing frequency of Computational and Theoretical Chemistry?
How many articles did Computational and Theoretical Chemistry publish last year?
What is the eISSN & pISSN for Computational and Theoretical Chemistry?
What is Citescore for Computational and Theoretical Chemistry?
What is SNIP score for Computational and Theoretical Chemistry?
What is the SJR for Computational and Theoretical Chemistry?
Who is the publisher of Computational and Theoretical Chemistry?
Check if your manuscript is a good match for
undefined
Upload your manuscript to get recommendations of journals
that have published papers similar to your manuscript
Drag and drop your file here
We accept manuscripts in English. File format: .doc and .docx | Maximum size: 10 MB | Word count: 200-300,000 words | File length: less than 100 pages
Do not have a manuscript right now? Use an abstract or summary
Your document is 100% secure & confidential We use 256-bit encryption for total security and
ISO/IEC 27001:2013 Certified
What all does the report include
01. Degree of Match
02. Common Topics
03. Additional
Recommendations
Recommendations