WildKets

Sirianni Lab @ Daemen University

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Research Projects

Scholarly activities of the WildKets in the field of quantum biochemistry

Killing Cancer is (Di)Radical!

Understanding the Bergman Cyclization: Producing Aromatic Diradicals for Anti-Tumor Applications

Embedded Symmetry-Adapted Perturbation Theory (ESAPT)

Coming soon!

How does extended protein environment tune host-guest binding?

Coming soon!

How additive are many-body interactions in heterogeneous molecular clusters?

Coming soon!

Psi4: Free & Open Source Quantum Chemistry

Psi4Education: A "Dry" Alternative to the Wet Lab

Psi4NumPy: Interactive Quantum Chemistry for Rapid Prototyping, Reference Implementation, & Education

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