List of works - Lipi Thukral

A rigorous framework for detecting SARS-CoV-2 spike protein mutational ensemble from genomic and structural features

scientific article published on 13 November 2021

Common folding mechanism of a beta-hairpin peptide via non-native turn formation revealed by unbiased molecular dynamics simulations

scientific article published on 01 December 2009

Deciphering the Role of Intramolecular Networking in Cholic Acid-Peptide Conjugates on the Lipopolysaccharide Surface in Combating Gram-Negative Bacterial Infections

scientific article published on 11 February 2019

Decoding Structural Properties of a Partially Unfolded Protein Substrate: En Route to Chaperone Binding

scientific article published on 22 September 2015

Distinct Intramolecular Hydrogen Bonding Dictates Antimicrobial Action of Membrane-Targeting Amphiphiles

scientific article published on 05 February 2019

Human LC3 and GABARAP subfamily members achieve functional specificity via specific structural modulations

scientific article published on 28 April 2019

Lipidated proteins: Spotlight on protein-membrane binding interfaces.

scientific article published on 3 February 2017

Monitoring the folding kinetics of a β-hairpin by time-resolved IR spectroscopy in silico.

scientific article

ProRegIn: a regularity index for the selection of native-like tertiary structures of proteins.

scientific article

Probing molecular forces in multi-component physiological membranes.

scientific article published on 27 November 2017

Revealing Conformational Transitions in G-Protein-Coupled Receptor Rhodopsin upon Phosphorylation

scientific article published on 26 December 2019

Specific Cholesterol Binding Drives Drastic Structural Alterations in Apolipoprotein A1

scientific article published on 04 October 2018

Structure and dynamics of DRD4 bound to an agonist and an antagonist using in silico approaches

scientific article published on 26 March 2015

Structured pathway across the transition state for peptide folding revealed by molecular dynamics simulations

scientific article

The Molecular Mechanism Underlying Recruitment and Insertion of Lipid-Anchored LC3 Protein into Membranes

scientific article

β-Structure within the Denatured State of the Helical Protein Domain BBL.

scientific article published on 14 August 2015

List of works by Lipi Thukral

A rigorous framework for detecting SARS-CoV-2 spike protein mutational ensemble from genomic and structural features

Common folding mechanism of a beta-hairpin peptide via non-native turn formation revealed by unbiased molecular dynamics simulations

Deciphering the Role of Intramolecular Networking in Cholic Acid-Peptide Conjugates on the Lipopolysaccharide Surface in Combating Gram-Negative Bacterial Infections

Decoding Structural Properties of a Partially Unfolded Protein Substrate: En Route to Chaperone Binding

Distinct Intramolecular Hydrogen Bonding Dictates Antimicrobial Action of Membrane-Targeting Amphiphiles

Human LC3 and GABARAP subfamily members achieve functional specificity via specific structural modulations

Lipidated proteins: Spotlight on protein-membrane binding interfaces.

Monitoring the folding kinetics of a β-hairpin by time-resolved IR spectroscopy in silico.

ProRegIn: a regularity index for the selection of native-like tertiary structures of proteins.

Probing molecular forces in multi-component physiological membranes.

Revealing Conformational Transitions in G-Protein-Coupled Receptor Rhodopsin upon Phosphorylation

Specific Cholesterol Binding Drives Drastic Structural Alterations in Apolipoprotein A1

Structure and dynamics of DRD4 bound to an agonist and an antagonist using in silico approaches

Structured pathway across the transition state for peptide folding revealed by molecular dynamics simulations

The Molecular Mechanism Underlying Recruitment and Insertion of Lipid-Anchored LC3 Protein into Membranes

β-Structure within the Denatured State of the Helical Protein Domain BBL.