<p>RMSF values along whole protein sequence (A), sum of RMSF values of each HSA domain (B), and difference of RMSF values between PCB-HSA complexes and free HSA, with marked amino acid (aa) residues involved in PCB binding for site IB (C), and for site IIA (D).</p
(A) RMSF profiles and (B) RMSD distribution calculated for analyzed systems of cruzain. Each paramet...
<p>A) The evolution of the RMSD (Root Mean Square Deviation) of WT-g14-3-3 (in red) and Pho-g14-3-3 ...
<p>(a) RMSF plot for HDAC2-C8 complex (yellow) and HDAC2 without ligand (red). (b) RMSF plot for HDA...
<p>RMSFs calculated for the main residues 53–56, 82, 87, and 90 that are in contact with the ligand ...
<p>A comparison between the RMSF plot for natural structures of proteins, proteins adsorbed onto the...
<p>The figure shows backbone RMSF of GP120 (A), IN (B), and NEF (C) in molecular dynamics simulation...
RMSD values of the top 4 compounds and talazoparib; and RMSF values of the PARP1 protein during perf...
<p>For the complexes, the corresponding ligand RMSD-values are depicted as green curves.</p
<p>(A) The backbone atom root mean square deviation (RMSD) for apo, inhibitor bound, apo (truncated)...
RMSD value for scFv–FuBc interaction was higher than that of the individual proteins.</p
<p>The RMSF plots of all systems (A) full protein and (B) important active site residues.</p
MD Simulation RMSD Plot of C-alpha atoms in proteins and ligands (A) Hesperetin (B) Curcumin (C) Iso...
<p>(A) The Root Mean Square Fluctuations (RMSF) profile of RpfCc of the 60 ns MD simulation versus t...
<p>Structural stability of the HIF-2α protein backbone compared between the simulated systems. For c...
<p>Rmsf was calculated across the Apo-TcdB simulation, and mapped onto the TcdB structure. Ribbons a...
(A) RMSF profiles and (B) RMSD distribution calculated for analyzed systems of cruzain. Each paramet...
<p>A) The evolution of the RMSD (Root Mean Square Deviation) of WT-g14-3-3 (in red) and Pho-g14-3-3 ...
<p>(a) RMSF plot for HDAC2-C8 complex (yellow) and HDAC2 without ligand (red). (b) RMSF plot for HDA...
<p>RMSFs calculated for the main residues 53–56, 82, 87, and 90 that are in contact with the ligand ...
<p>A comparison between the RMSF plot for natural structures of proteins, proteins adsorbed onto the...
<p>The figure shows backbone RMSF of GP120 (A), IN (B), and NEF (C) in molecular dynamics simulation...
RMSD values of the top 4 compounds and talazoparib; and RMSF values of the PARP1 protein during perf...
<p>For the complexes, the corresponding ligand RMSD-values are depicted as green curves.</p
<p>(A) The backbone atom root mean square deviation (RMSD) for apo, inhibitor bound, apo (truncated)...
RMSD value for scFv–FuBc interaction was higher than that of the individual proteins.</p
<p>The RMSF plots of all systems (A) full protein and (B) important active site residues.</p
MD Simulation RMSD Plot of C-alpha atoms in proteins and ligands (A) Hesperetin (B) Curcumin (C) Iso...
<p>(A) The Root Mean Square Fluctuations (RMSF) profile of RpfCc of the 60 ns MD simulation versus t...
<p>Structural stability of the HIF-2α protein backbone compared between the simulated systems. For c...
<p>Rmsf was calculated across the Apo-TcdB simulation, and mapped onto the TcdB structure. Ribbons a...
(A) RMSF profiles and (B) RMSD distribution calculated for analyzed systems of cruzain. Each paramet...
<p>A) The evolution of the RMSD (Root Mean Square Deviation) of WT-g14-3-3 (in red) and Pho-g14-3-3 ...
<p>(a) RMSF plot for HDAC2-C8 complex (yellow) and HDAC2 without ligand (red). (b) RMSF plot for HDA...