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The role of disulfide bonds in a Solanum tuberosum saposin-like protein  investigated using molecular dynamics | PLOS ONE
The role of disulfide bonds in a Solanum tuberosum saposin-like protein investigated using molecular dynamics | PLOS ONE

Dissecting Role of Charged Residue from Transmembrane Domain 5 of Latent  Membrane Protein 1 via In Silico Simulations and Wet-Lab Experiments | The  Journal of Physical Chemistry B
Dissecting Role of Charged Residue from Transmembrane Domain 5 of Latent Membrane Protein 1 via In Silico Simulations and Wet-Lab Experiments | The Journal of Physical Chemistry B

Root Mean Square Fluctuation. Per-residue root mean square fluctuation... |  Download Scientific Diagram
Root Mean Square Fluctuation. Per-residue root mean square fluctuation... | Download Scientific Diagram

YASARA Molecular Dynamics Trajectory Analysis for 4mbs
YASARA Molecular Dynamics Trajectory Analysis for 4mbs

Computational drug repurposing strategy predicted peptide-based drugs that  can potentially inhibit the interaction of SARS-CoV-2 spike protein with  its target (humanACE2) | PLOS ONE
Computational drug repurposing strategy predicted peptide-based drugs that can potentially inhibit the interaction of SARS-CoV-2 spike protein with its target (humanACE2) | PLOS ONE

Computational drug repurposing strategy predicted peptide-based drugs that  can potentially inhibit the interaction of SARS-CoV-2 spike protein with  its target (humanACE2) | PLOS ONE
Computational drug repurposing strategy predicted peptide-based drugs that can potentially inhibit the interaction of SARS-CoV-2 spike protein with its target (humanACE2) | PLOS ONE

Heat map of the covariance matrix for fluctuations in MD calculated... |  Download Scientific Diagram
Heat map of the covariance matrix for fluctuations in MD calculated... | Download Scientific Diagram

Distance-Based Configurational Entropy of Proteins from Molecular Dynamics  Simulations | PLOS ONE
Distance-Based Configurational Entropy of Proteins from Molecular Dynamics Simulations | PLOS ONE

Beginning Trajectory Analysis
Beginning Trajectory Analysis

A Computational Analysis of the Factors Governing the Dynamics of α7  nAChR and Its Homologs
A Computational Analysis of the Factors Governing the Dynamics of α7 nAChR and Its Homologs

Binding of regulatory proteins to nucleosomes is modulated by dynamic  histone tails | Nature Communications
Binding of regulatory proteins to nucleosomes is modulated by dynamic histone tails | Nature Communications

RMSD time plot. C-alpha root mean square deviation variation with... |  Download Scientific Diagram
RMSD time plot. C-alpha root mean square deviation variation with... | Download Scientific Diagram

Fluctuations and Correlations in Crystalline Protein Dynamics: A Simulation  Analysis of Staphylococcal Nuclease - ScienceDirect
Fluctuations and Correlations in Crystalline Protein Dynamics: A Simulation Analysis of Staphylococcal Nuclease - ScienceDirect

AlphaFold2 models indicate that protein sequence determines both structure  and dynamics | Scientific Reports
AlphaFold2 models indicate that protein sequence determines both structure and dynamics | Scientific Reports

Residue Geometry Networks: A Rigidity-Based Approach to the Amino Acid  Network and Evolutionary Rate Analysis | Scientific Reports
Residue Geometry Networks: A Rigidity-Based Approach to the Amino Acid Network and Evolutionary Rate Analysis | Scientific Reports

Detect regions of high mobility in a protein simulation. – AMBER-hub
Detect regions of high mobility in a protein simulation. – AMBER-hub

Example for how to calculate the root mean square fluctuation (RMSF)... |  Download Scientific Diagram
Example for how to calculate the root mean square fluctuation (RMSF)... | Download Scientific Diagram

Comparison of residue fluctuation (root mean square fluctuation (RMSF))...  | Download Scientific Diagram
Comparison of residue fluctuation (root mean square fluctuation (RMSF))... | Download Scientific Diagram

Example for how to calculate the root mean square fluctuation (RMSF)... |  Download Scientific Diagram
Example for how to calculate the root mean square fluctuation (RMSF)... | Download Scientific Diagram

IJMS | Free Full-Text | Molecular Dynamics-Derived Pharmacophore Model  Explaining the Nonselective Aspect of KV10.1 Pore Blockers | HTML
IJMS | Free Full-Text | Molecular Dynamics-Derived Pharmacophore Model Explaining the Nonselective Aspect of KV10.1 Pore Blockers | HTML

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vmdICE»

Root Mean Square Fluctuation. Per-residue root mean square fluctuation... |  Download Scientific Diagram
Root Mean Square Fluctuation. Per-residue root mean square fluctuation... | Download Scientific Diagram

Detect regions of high mobility in a protein simulation. – AMBER-hub
Detect regions of high mobility in a protein simulation. – AMBER-hub

Figure S3. Per-residue fluctuation of the b-factor during simulation... |  Download Scientific Diagram
Figure S3. Per-residue fluctuation of the b-factor during simulation... | Download Scientific Diagram

Residual Sum of Squares - Meaning, Formula, Examples, Calculate
Residual Sum of Squares - Meaning, Formula, Examples, Calculate

IJMS | Free Full-Text | Conserved Conformational Hierarchy across  Functionally Divergent Glycosyltransferases of the GT-B Structural  Superfamily as Determined from Microsecond Molecular Dynamics | HTML
IJMS | Free Full-Text | Conserved Conformational Hierarchy across Functionally Divergent Glycosyltransferases of the GT-B Structural Superfamily as Determined from Microsecond Molecular Dynamics | HTML

Docking studies and molecular dynamics simulations of the binding  characteristics of waldiomycin and its methyl ester analog to  Staphylococcus aureus histidine kinase | PLOS ONE
Docking studies and molecular dynamics simulations of the binding characteristics of waldiomycin and its methyl ester analog to Staphylococcus aureus histidine kinase | PLOS ONE

A molecular dynamics-guided mutagenesis identifies two aspartic acid  residues involved in the pH-dependent activity of OG-OXIDASE 1 -  ScienceDirect
A molecular dynamics-guided mutagenesis identifies two aspartic acid residues involved in the pH-dependent activity of OG-OXIDASE 1 - ScienceDirect