4 papers
Do Water Molecules Always Stabilize Resonances? Microhydration Effects on Thymine Shape Resonances
Sujan Mandal, Jishnu Narayanan S J, Ankita Gogoi +3
We investigate microhydration effects on the three low-lying Ï* shape resonances of thymine using the Resonance via Padé approach in combination with the DLPNO-EA-EOM-CCSD method…
The Effect of Base-Pairing on the Shape Resonances of Nucleobases
Jishnu Narayanan S J, Divya Tripathi, Idan Haritan +3
In this work, we have studied the effect of base-pairing on the shape resonances of guanine and cytosine nucleobases. Among the seven Ï* resonances we identified in the guanine-cy…
The Effect of Aqueous Medium on Nucleobase Shape Resonances: Insights from Microsolvation
Jishnu Narayanan, Divya Tripathi, Idan Haritan +1
We have studied the effect of microhydration on the shape resonances of uracil nucleobase. The resonance parameters were determined using the resonance via Padé approach along wit…
Effect of Protein Environment on the Shape Resonances of RNA Nucleobases: Insights From a Model System
Sneha Arora, Jishnu Narayanan S J, Idan Haritan +2
In this work, the effect of amino acid environment on the nucleobase-centered anion radical shape resonances is investigated by employing uracil as a model system for pyrimidine ba…