Key Metrics
CiteScore 

10
Impact Factor 

5 - 10
Scite Index 

0.94 5-Year SI

SNIP 

1.48
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Topics Covered on Journal of Chemical Theory and Computation
Journal of Chemical Theory and Computation Journal Specifications
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| Overview | |
| Publisher | AMER CHEMICAL SOC |
| Language | English |
| Frequency | Monthly |
| General Details | |
| Language | English |
| Frequency | Monthly |
| Publication Start Year | 2005 |
| Publisher URL | Visit website |
| Website URL | Visit website |
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Recently Published Papers in Journal of Chemical Theory and Computation
Constructing Compact ADAPT Unitary Coupled-Cluster Ansatz with Parameter-Based Criterion.
- 13 May 2026
- Journal of chemical theory and computation
Dynamics of Electronically Inelastic and Reactive Collisions of O(1D) with N2 Based on Machine-Learned Coupled Potential Energy Surfaces.
- 13 May 2026
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MolSculptor: An Adaptive Diffusion-Evolution Framework Enabling Generative Drug Design for Multitarget Affinity and Selectivity.
- 13 May 2026
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Molecular Dynamics Workflows to Compute Large-Scale Sets of Absolute Binding Free Energies Aiding Drug Candidate and Binding Pose Selection.
- 13 May 2026
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Energy Eigenstates of Electrons, Magnons, and Phonons in Fe3O4 (Magnetite), MnFe2O4 (Jacobsite), and Mixed Mn-Zn Ferrites.
- 13 May 2026
- Journal of chemical theory and computation
Improving Protein Structure Prediction Using Integrative Cryo-EM and Ion Mobility Mass Spectrometry Modeling.
- 13 May 2026
- Journal of chemical theory and computation
Constructing Compact ADAPT Unitary Coupled-Cluster Ansatz with Parameter-Based Criterion.
- 13 May 2026
- Journal of chemical theory and computation
Dynamics of Electronically Inelastic and Reactive Collisions of O(1D) with N2 Based on Machine-Learned Coupled Potential Energy Surfaces.
- 13 May 2026
- Journal of chemical theory and computation
MolSculptor: An Adaptive Diffusion-Evolution Framework Enabling Generative Drug Design for Multitarget Affinity and Selectivity.
- 13 May 2026
- Journal of chemical theory and computation
Molecular Dynamics Workflows to Compute Large-Scale Sets of Absolute Binding Free Energies Aiding Drug Candidate and Binding Pose Selection.
- 13 May 2026
- Journal of chemical theory and computation
Energy Eigenstates of Electrons, Magnons, and Phonons in Fe3O4 (Magnetite), MnFe2O4 (Jacobsite), and Mixed Mn-Zn Ferrites.
- 13 May 2026
- Journal of chemical theory and computation
Improving Protein Structure Prediction Using Integrative Cryo-EM and Ion Mobility Mass Spectrometry Modeling.
- 13 May 2026
- Journal of chemical theory and computation
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