Sergei Grudinin

26PUBLICATIONS
81CO-AUTHORS
Proteomics and metabolomicsOptimisationStatistical mechanics in chemistryProteins and peptidesStructure and dynamics of materials
Featured researcher

Get your video featured.

JoVEPublish with JoVE
Journal

Publications (26)

|Jul 20, 2026
PETIMOT: a novel framework for inferring protein motions from sparse data using SE(3)-equivariant graph neural networks.

|Jun 15, 2026
Erratum: "Anisotropic coarse-grain Monte Carlo simulations of lysozyme, lactoferrin, and NISTmAb by precomputing atomistic models" [J. Chem. Phys. 161, 094113 (2024)].

|Jun 09, 2026
From Intermolecular Poses to Thermodynamics Using Subdivided Spheres.

|Mar 19, 2026
Effects of Mutations on Tandem-Repeat Proteins Conformation Mechanisms. Application to the Phosphatase PP2A.

Matias Chiappinelli, Tadeo E Saldaño, Silvio C E Tosatto

|Feb 25, 2026
SimHS-AFMfit-MD: An Integrative Approach for Inferring Alpha-Actinin Atomic Conformational Dynamics.

Kien Xuan Ngo, Takashi Sumikama, Rémi Vuillemot

|Jan 07, 2026
Systematic analyses of lipid mobilization by human lipid transfer proteins.

Kevin Titeca, Antonella Chiapparino, Marco L Hennrich

Pageof 5

Frequent Collaborators

3 joint publications

Mikael Lund

3 joint publications

Harold W Hatch

3 joint publications

Elodie Laine

2 joint publications

Marco A Blanco