Theoretical investigation of hydroxylated analogues of valinomycin as potassium transporter

Author:

Sessa LuciaORCID,Concilio SimonaORCID,Marrafino FrancescoORCID,Sarkar Arkadeep,Diana Rosita,Piotto Stefano

Funder

Regione Campania

Publisher

Elsevier BV

Subject

Computational Mathematics,Organic Chemistry,Biochemistry,Structural Biology

Reference49 articles.

1. Site‐dependent biological activity of valinomycin analogs bearing derivatizable hydroxyl sites;Annese;J. Pept. Sci.,2013

2. GFN2-xTB—an accurate and broadly parametrized self-consistent tight-binding quantum chemical method with multipole electrostatics and density-dependent dispersion contributions;Bannwarth;J. Chem. Theory Comput.,2019

3. Extended tight‐binding quantum chemistry methods;Bannwarth;Wiley Interdiscip. Rev.: Comput. Mol. Sci.,2021

4. How the configurational changes influence on molecular characteristics. The alkyl 3-azido-2,3-dideoxy-D-hexopyranosides - Theoretical approach;Barabaś;Carbohydr. Res.,2019

5. Investigating Protein–Peptide Interactions Using the Schrödinger Computational Suite;Bhachoo,2017

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