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Review Cycle Records

JOURNAL OF COMPUTATIONAL CHEMISTRY

Wiley SCIE Non-OA
2026 Emerging Zone 32025 CAS Zone 32025 JCR Q2
70.9Average days
49.5Median days
30Fastest days
223Longest days
3282025 publications

Paper Review Records

All Paper Review Records

20 valid samples · Newest publication first
Review days = acceptance date − received date. PDF, DOI, and publisher-page sources are retained.

37 days

Breaking the Ceiling of Boron‐Boron Bonds: Understanding and Fine‐Tuning Basicity in Diborane(4) Complexes

AuthorsManuel Yáñez; Otilia Mó; M. Merced Montero‐Campillo; Ibon Alkorta

Affiliations1. Departamento de Química, Facultad de Ciencias Universidad Autónoma de Madrid, Campus de Excelencia UAM‐CSIC Madrid Spain; 2. Institute for Advanced Research in Chemical Sciences (IAdChem), Facultad de Ciencias Universidad Autónoma de Madrid, Campus de Excelencia UAM‐CSIC Madrid Spain; 3. Instituto de Química Médica y Biomedicina (IQMB), CSIC Madrid Spain

Source PDF DOI Publisher page
114 days

A Graph‐Based Machine Learning Framework to Assign Empirical Interaction Parameters for Novel Molecules

AuthorsYao Fu; Martin Stroet; Megan L. O'Mara

Affiliations1. Australian Institute for Bioengineering and Nanotechnology, The University of Queensland St Lucia Queensland Australia; 2. ARC Centre of Excellence in Quantum Biotechnology The University of Queensland St Lucia Queensland Australia; 3. School of Chemistry and Molecular Biosciences The University of Queensland St Lucia Queensland Australia

Source PDF DOI Publisher page
42 days

Benchmark Reference Data and Computational Protocols for Predicting Excitation Energies of Thioindigoid Photoswitches

AuthorsElias Harrer; Carolin Müller; Dirk Zahn

Affiliations1. Chair of Theoretical Chemistry Friedrich‐Alexander‐Universität Erlangen‐Nürnberg Erlangen Germany; 2. Computer Chemistry Center, CCC Friedrich‐Alexander‐Universität Erlangen‐Nürnberg Erlangen Germany

Source PDF DOI Publisher page
46 days

Boosting CO 2 Hydrogenation to Formic Acid Through Secondary Metal Promotion in Fe 3 O ‐Based MOF Catalysts

AuthorsPavee Apilardmongkol; Manussada Ratanasak; Sirilak Kongkaew; Wilasinee Santiwarodom; Thanawit Kuamit; Tatiya Chokbunpiam; Fadjar Mulya; Thanyada Rungrotmongkol; Jun‐ya Hasegawa; Yasuteru Shigeta; Vudhichai Parasuk

Affiliations1. Center of Excellence in Computational Chemistry, Department of Chemistry Faculty of Science, Chulalongkorn University Bangkok Thailand; 2. Center for Computational Sciences, University of Tsukuba Ibaraki Japan; 3. Center of Excellence in Biocatalyst and Sustainable Biotechnology, Department of Biochemistry, Faculty of Science Chulalongkorn University Bangkok Thailand; 4. Department of Chemistry Faculty of Science, Ramkhamhaeng University Bangkok Thailand; 5. Nanotechnology Engineering Program, Faculty of Advanced Technology and Multidiscipline, Universitas Airlangga Surabaya Indonesia; 6. Program in Bioinformatics and Computational Biology, College of Interdisciplinary and Integrative Studies, Chulalongkorn University Bangkok Thailand; 7. Institute for Catalysis, Hokkaido University Sapporo Hokkaido Japan

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49 days

CO and NO Detection by MN 4 @ SWCNT in Background Gases: Multiscale DFT , Microkinetic, Boltzmann Transport Study

AuthorsAdhitya Gandaryus Saputro; Ira Puspitasari; Dicky Setianto; Farrel Dzaudan Naufal; Imran Shakir; Chin‐Sung Hsiao; Febdian Rusydi

Affiliations1. Quantum and Nano Technology Research Group Bandung Institute of Technology Bandung Indonesia; 2. Research Center for Nanosciences and Nanotechnology Institut Teknologi Bandung Bandung Indonesia; 3. Information Systems Study Program, Faculty of Science and Technology Universitas Airlangga Surabaya Indonesia; 4. Research Center for Quantum Engineering and Bio‐Medical Physics, Faculty of Science and Technology Universitas Airlangga Surabaya Indonesia; 5. Department of Physics, Faculty of Science Islamic University of Madinah Madinah Saudi Arabia; 6. Department of Computer Science and Information Engineering, College of Information and Electrical Engineering Asia University Taichung Taiwan; 7. Department of Physics, Faculty of Science and Technology Universitas Airlangga Surabaya Indonesia

Source PDF DOI Publisher page
50 days

Substituent Effects on the Stability of Pd– NHC Complexes: Switching From Molecular to “Cocktail‐Type” Catalysis

AuthorsVladislav O. Naumovich; Evgeniy G. Gordeev; Valentine P. Ananikov

Affiliations1. N.D. Zelinsky Institute of Organic Chemistry, Russian Academy of Sciences Moscow Russia

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44 days

Predicting the Stepwise Growth of Lithium Clusters Around Sulfur Species (S and S 2 ) From the Topology of the Electron Localization Function

AuthorsMohammad Esmaïl Alikhani

Affiliations1. Sorbonne Université, CNRS, De la Molécule Aux Nano‐Objets: Réactivité, Interactions et Spectroscopies, MONARIS Paris France

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41 days

Natural Atomic Orbitals at the Complete‐Basis‐Set Limit: A Frozen Natural‐Minimal‐Basis Construction

AuthorsDariusz W. Szczepanik

Affiliations1. K. Gumiński Department of Theoretical Chemistry, Faculty of Chemistry Jagiellonian University Kraków Poland

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54 days

DL_FFLUX Refactored: Accelerating Quantum Chemical Topology Simulations With Optimized Parallelization

AuthorsMohamadhosein Nosratjoo; Michael K. Bane; Paul L. A. Popelier

Affiliations1. Department of Chemistry The University of Manchester Manchester UK; 2. High End Compute LTD Manchester UK; 3. Department of Computing and Mathematics Manchester Metropolitan University Manchester UK

Source PDF DOI Publisher page
32 days

Deployment‐Matched Allocation of PBE , mBJ , and HSE06 for Band‐Gap Screening Under Chemical and Protocol Shifts

AuthorsXiyao Yu

Affiliations1. School of Chemistry, Chemical Engineering and Biotechnology, Nanyang Technological University Singapore Singapore

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Suggested title
Machine Learning and Life-Cycle Assessment for Predicting and Optimizing Carbon Emissions in Urban Wastewater Treatment

SampleLatest 5 valid paper samples from 2026

Average review96.4 days

Median77 days

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