Theoretical Chemistry

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Theoretical Chemistry

Theoretical chemistry at Harvard covers a broad range of topics from electronic structure theory to protein folding, and brings chemical principles to bear on disciplines not traditionally associated with chemistry, such as evolution and quantum information.

Theoretical Chemistry Faculty

Adam Cohen

John P. Reardon Jr. Professor of Chemistry & Chemical Biology and of Physics
(Accepting Graduate Students)
Laboratory Manager: Hillary Piccerillo Adam Cohen works at the interface of physics, chemistry and biology. His lab develops new physical tools to study molecules and cells. The Cohen Lab developed fluorescent voltage-indicating proteins which enable...
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Eric Heller

Abbott and James Lawrence Professor of Chemistry
Professor of Physics
(Accepting Graduate Students)
Laboratory Manager/Administrator: Pattee McGarry Eric Heller joined the physics faculty at Harvard in 1993, and became a CCB faculty member in 2009. He received his PhD in Chemical Physics from Harvard. His research centers on time dependent and...
A headshot of Eric Heller

Eugene I. Shakhnovich

Roy G. Gordon Professor of Chemistry
(Accepting Graduate Students)
Laboratory Manager/Administrator: Pattee McGarry The research of Professor Eugene Shakhnovich and his group is directed towards understanding the basic principles of protein folding and structural and dynamical properties of other complex polymer systems...
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Joonho Lee

Assistant Professor of Chemistry and Chemical Biology
(Accepting Graduate Students)
Laboratory Administrator: Pattee McGarry The Lee group develops and implements theoretical and computational methods to study a wide range of exciting phenomena in nature, whose understanding is challenged by electron-electron, electron-vibration...
Joonho Lee

Recent News

New research: How to build an evolutionary trap for viruses

When a virus mutates, the world usually finds out the hard way. Variants of influenza and SARS-CoV-2 can slip past vaccines and antibody drugs before scientists fully understand what has changed. A new study from the Department of Chemistry and Chemical...
Eugene Shakhnovich and Vaibhav Mohanty

Adam Cohen receives Genomic Medicines Fund award

The Office of the Vice Provost for Research (OVPR) is pleased to announce that awards have been made to five projects from the Harvard University Genomic Medicines Fund. The fund is intended to support of research involving genome editing that is useful...
Adam Cohen