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Building a nanoHUB Graphical Interface for Exploring Protein Dynamics and Spectroscopy: the PigmentHunter App
Online Presentations | 18 Apr 2024 | Contributor(s):: Safa Ahad
Running and analyzing protein molecular dynamics (MD) simulations can be time consuming and tedious. In this webinar, we introduce PigmentHunter , an online nanoHUB tool that enables “point-and-click” MD-based simulation of excitonic spectra of chlorophyll proteins based on PDB...
Photosynthetic Protein Spectroscopy Lab
Tools | 19 Oct 2020 | Contributor(s):: Safa Ahad, Chientzu Lin, Michael Earl Reppert
This tool parses PDB structures of photosynthetic proteins to identify pigments, calculate inter-pigment interactions, and simulate optical spectra for the complex.
Molecular Spectroscopy
Tools | 12 Aug 2020 | Contributor(s):: Michael Earl Reppert
Front-end for content of Purdue course CHM676 (Molecular Spectroscopy).
Samir Nadim Tohme
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