Skip to main page content
U.S. flag

An official website of the United States government

Dot gov

The .gov means it’s official.
Federal government websites often end in .gov or .mil. Before sharing sensitive information, make sure you’re on a federal government site.

Https

The site is secure.
The https:// ensures that you are connecting to the official website and that any information you provide is encrypted and transmitted securely.

Access keys NCBI Homepage MyNCBI Homepage Main Content Main Navigation

Search Page

Filters

My NCBI Filters

Text availability

Article attribute

Article type

Publication date

Search Results

4 results

Filters applied: . Clear all
Results are displayed in a computed author sort order. The Results By Year timeline is not available.
Page 1
Electronic Structure of de Novo Peptide ACC-Hex from First Principles.
Lewis DK, Oh Y, Mohanam LN, Wierzbicki M, Ing NL, Gu L, Hochbaum A, Wu R, Cui Q, Sharifzadeh S. Lewis DK, et al. Among authors: mohanam ln. J Phys Chem B. 2022 Jun 7. doi: 10.1021/acs.jpcb.2c02346. Online ahead of print. J Phys Chem B. 2022. PMID: 35671500
NEXMD v2.0 Software Package for Nonadiabatic Excited State Molecular Dynamics Simulations.
Freixas VM, Malone W, Li X, Song H, Negrin-Yuvero H, Pérez-Castillo R, White A, Gibson TR, Makhov DV, Shalashilin DV, Zhang Y, Fedik N, Kulichenko M, Messerly R, Mohanam LN, Sharifzadeh S, Bastida A, Mukamel S, Fernandez-Alberti S, Tretiak S. Freixas VM, et al. Among authors: mohanam ln. J Chem Theory Comput. 2023 Aug 22;19(16):5356-5368. doi: 10.1021/acs.jctc.3c00583. Epub 2023 Jul 28. J Chem Theory Comput. 2023. PMID: 37506288