MD-DFT Computational Studies on the Mechanistic and Conformational Parameters for the Chemoselective Tyrosine Residue Reactions of G-Protein-Coupled Receptor Peptides with [Cp*Rh(H2O)3](OTf)2 in Water To Form Their [(η6-Cp*Rh-Tyr#)-GPCR peptide]2+ ...
![Quantum Reports | Free Full-Text | Cyclic Six-Atomic Boron-Nitrides: Quantum-Chemical Consideration by Ab Initio CCSD(T) Method Quantum Reports | Free Full-Text | Cyclic Six-Atomic Boron-Nitrides: Quantum-Chemical Consideration by Ab Initio CCSD(T) Method](https://pub.mdpi-res.com/quantumrep/quantumrep-04-00025/article_deploy/html/images/quantumrep-04-00025-g001.png?1663312206)
Quantum Reports | Free Full-Text | Cyclic Six-Atomic Boron-Nitrides: Quantum-Chemical Consideration by Ab Initio CCSD(T) Method
![Molecules | Free Full-Text | A Statistically Supported Antioxidant Activity DFT Benchmark—The Effects of Hartree–Fock Exchange and Basis Set Selection on Accuracy and Resources Uptake Molecules | Free Full-Text | A Statistically Supported Antioxidant Activity DFT Benchmark—The Effects of Hartree–Fock Exchange and Basis Set Selection on Accuracy and Resources Uptake](https://pub.mdpi-res.com/molecules/molecules-26-05058/article_deploy/html/images/molecules-26-05058-ag.png?1629882625)
Molecules | Free Full-Text | A Statistically Supported Antioxidant Activity DFT Benchmark—The Effects of Hartree–Fock Exchange and Basis Set Selection on Accuracy and Resources Uptake
5-Endo-trig Radical Cyclizations: Disfavored or Favored Processes? | Journal of the American Chemical Society
![The ABC of Insulin: The Organic Chemistry of a Small Protein - Østergaard - 2020 - Chemistry – A European Journal - Wiley Online Library The ABC of Insulin: The Organic Chemistry of a Small Protein - Østergaard - 2020 - Chemistry – A European Journal - Wiley Online Library](https://chemistry-europe.onlinelibrary.wiley.com/cms/asset/ceefbeed-173f-49fa-b6d2-c0cf65793f56/chem202000337-toc-0001-m.png)
The ABC of Insulin: The Organic Chemistry of a Small Protein - Østergaard - 2020 - Chemistry – A European Journal - Wiley Online Library
Cyclopropenylidene: Clustering and Interaction with Water Molecules | The Journal of Physical Chemistry A
![Molecules | Free Full-Text | An Efficient Approach to Large-Scale Ab Initio Conformational Energy Profiles of Small Molecules Molecules | Free Full-Text | An Efficient Approach to Large-Scale Ab Initio Conformational Energy Profiles of Small Molecules](https://pub.mdpi-res.com/molecules/molecules-27-08567/article_deploy/html/images/molecules-27-08567-g001.png?1670238004)
Molecules | Free Full-Text | An Efficient Approach to Large-Scale Ab Initio Conformational Energy Profiles of Small Molecules
![Frontiers | Brain-wide neuronal activation and functional connectivity are modulated by prior exposure to repetitive learning episodes Frontiers | Brain-wide neuronal activation and functional connectivity are modulated by prior exposure to repetitive learning episodes](https://www.frontiersin.org/files/Articles/907707/fnbeh-16-907707-HTML/image_m/fnbeh-16-907707-g001.jpg)