<p>(A) for PBP2x-R61-CES. (B) for PBP2x-A7-CES. Bond 1: Ser396 O - CES O7; Bond 2: Gly350 N - CES O3; Bond 3: Thr351 OG1 - CES N2; Bond 4:Thr351 OG1 - CES O5; and Bond 5: Thr351 N - CES O5.</p
a<p> Peptide-PKA heavy atoms that form a HB (Notations of atoms refer to the name of atoms from the ...
<p>The figure shows the intermolecular H-bonds formed between HCTR1 and NADPH in the final represent...
<p>The interatomic distances of six representative bonds were plotted against simulation time, where...
<p><sup><i>a</i></sup>Occupancy of hydrogen bonds (The occupancy >70% were listed).</p><p><sup><i>b<...
<p>(A) Snapshots at 1 ps, 300 ps, 700 ps and 1000 ps. (B) Distances from the O<sup>ε1</sup> and O<su...
<p>For each S620–N629 C distance (right), the number of hydrogen bonds formed by the N629 side-chain...
<p>[a] Occupancy of hydrogen bonds (The occupancy >70% were listed).</p><p>[b] Hydrogen bond distanc...
<div><p>(A) During the 10-ns control simulation.</p><p>(B) During the 4-ns TMD simulation.</p><p>Det...
<p>Plot of the H-bond length for the central A⋯T bp of the model M3, for a MD simulation of 950 ns a...
<p>(a) Hydrogen bonds for HDAC2-C8 complex (yellow). (b) Hydrogen bonds for HDAC8-C8 complex (green)...
<p>Tyr714 and Glu658 are not hydrogen bonded in the 1L3S PDB (corresponding to a distance of 6.3 Å) ...
<p>The distances between H11 and H12 of the four systems throughout the 100 ns molecular dynamics si...
<p>The H-bond distance was taken from an averaged snapshot selected from the MD simulation.</p
<p>The transverse distance changes (A) and the lengthways distance changes (B) of the LRR domain spa...
Hydrogen bonds between compound 18 and compound 21 with NS2B/NS3pro that found with at least 0.1% oc...
a<p> Peptide-PKA heavy atoms that form a HB (Notations of atoms refer to the name of atoms from the ...
<p>The figure shows the intermolecular H-bonds formed between HCTR1 and NADPH in the final represent...
<p>The interatomic distances of six representative bonds were plotted against simulation time, where...
<p><sup><i>a</i></sup>Occupancy of hydrogen bonds (The occupancy >70% were listed).</p><p><sup><i>b<...
<p>(A) Snapshots at 1 ps, 300 ps, 700 ps and 1000 ps. (B) Distances from the O<sup>ε1</sup> and O<su...
<p>For each S620–N629 C distance (right), the number of hydrogen bonds formed by the N629 side-chain...
<p>[a] Occupancy of hydrogen bonds (The occupancy >70% were listed).</p><p>[b] Hydrogen bond distanc...
<div><p>(A) During the 10-ns control simulation.</p><p>(B) During the 4-ns TMD simulation.</p><p>Det...
<p>Plot of the H-bond length for the central A⋯T bp of the model M3, for a MD simulation of 950 ns a...
<p>(a) Hydrogen bonds for HDAC2-C8 complex (yellow). (b) Hydrogen bonds for HDAC8-C8 complex (green)...
<p>Tyr714 and Glu658 are not hydrogen bonded in the 1L3S PDB (corresponding to a distance of 6.3 Å) ...
<p>The distances between H11 and H12 of the four systems throughout the 100 ns molecular dynamics si...
<p>The H-bond distance was taken from an averaged snapshot selected from the MD simulation.</p
<p>The transverse distance changes (A) and the lengthways distance changes (B) of the LRR domain spa...
Hydrogen bonds between compound 18 and compound 21 with NS2B/NS3pro that found with at least 0.1% oc...
a<p> Peptide-PKA heavy atoms that form a HB (Notations of atoms refer to the name of atoms from the ...
<p>The figure shows the intermolecular H-bonds formed between HCTR1 and NADPH in the final represent...
<p>The interatomic distances of six representative bonds were plotted against simulation time, where...
DOI
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