Datta, Saptarshi; Kabir, Mohammad Pabel; Maliha, Sunjida Reza; Liu, Fang; Xu, Jinjia
ACS Applied Energy Materials
Combines molecular design, spectroscopy, and excited-state calculations to explain how 9-fluorenone derivatives access fluorescence, charge-transfer emission, phosphorescence, and delayed fluorescence under different molecular and environmental conditions.
Kabir, Mohammad Pabel; Ghosh, Paulami; Gozem, Samer
The Journal of Physical Chemistry B
Benchmarks multireference, TD-DFT, coupled-cluster-related, and other wave-function methods for flavin excited states, clarifying which computational choices are reliable for different spectroscopic and photophysical questions.
Kabir, Mohammad Pabel; Ouedraogo, Daniel; Orozco-Gonzalez, Yoelvis; Gadda, Giovanni; Gozem, Samer
The Journal of Physical Chemistry B
Uses electrostatic spectral-tuning maps, molecular dynamics, QM/MM calculations, mutagenesis, and spectroscopy to test a rational strategy for shifting the fluorescence of a flavin-binding fluorescent protein.
Kabir, Mohammad Pabel; Orozco-Gonzalez, Yoelvis; Hastings, Gary; Gozem, Samer
Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy
Connects hydrogen-bonding environments with changes in flavin infrared absorption and vibrational assignments.
Su, Dan; Kabir, Mohammad Pabel; Orozco-Gonzalez, Yoelvis; Gozem, Samer; Gadda, Giovanni
ChemBioChem
Combines spectroscopy and electronic-structure calculations to explain unusual fluorescence behavior of a flavin semiquinone radical stabilized in a protein.
Orozco-Gonzalez, Yoelvis; Kabir, Mohammad Pabel; Gozem, Samer
The Journal of Physical Chemistry B
Introduces three-dimensional maps that visualize how nearby charges tune the excitation energies of biological chromophores.
Kabir, Mohammad Pabel; Orozco-Gonzalez, Yoelvis; Gozem, Samer
Physical Chemistry Chemical Physics
Computes and interprets flavin spectra across redox and protonation states while mapping how surrounding electrostatics can shift observable transitions.
Zhu, Tianyu; Xu, Shichao; Rahman, Md. Anisur; Dogdibegovic, Emir; Yang, Peng; Pageni, Parasmani; Kabir, Mohammad Pabel; Zhou, Xiao-dong; Tang, Chuanbing
Angewandte Chemie International Edition
Reports cobaltocenium-based polyelectrolytes designed for chemically and mechanically robust alkaline anion-exchange membranes.
Pageni, Parasmani; Kabir, Mohammad Pabel; Yang, Peng; Tang, Chuanbing
Journal of Inorganic and Organometallic Polymers and Materials
Examines how charge and aromatic interactions influence binding between cobaltocenium-containing polyelectrolytes and anionic molecular or polymeric probes.
Yan, Yi; Pageni, Parasmani; Kabir, Mohammad Pabel; Tang, Chuanbing
Synlett
Reviews metallocenium chemistry and its development as a platform for functional macromolecular and polyelectrolyte materials.
Yang, Peng; Pageni, Parasmani; Kabir, Mohammad Pabel; Zhu, Tianyu; Tang, Chuanbing
ACS Macro Letters
Demonstrates light-controlled RAFT polymerization of metallocene-containing monomers and the preparation of heterobimetallic block copolymers.
Kabir, Mohammad Pabel
University of South Carolina
Investigates cobaltocenium-containing polymers, their interactions with organic anions, and their potential use in alkaline anion-exchange membranes.
Kabir, Md Pabel; Islam, Md Manuarul; Masum, Shah Md; Hossain, Md Mufazzal
Bangladesh Journal of Scientific and Industrial Research
Studies the equilibrium, kinetics, and thermodynamics of dye adsorption onto chitosan from aqueous solution.