Words similar to electrostatic
Example sentences for: electrostatic
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All sequenced subclass Ba and Bb metallo-β-lactamases (except VIM-1) have a lysine residue at position 224 [ 41 ] , and all computational models for substrate binding to the metallo-β-lactamases assume that the invariant carboxylate on substrates forms an electrostatic interaction with this lysine.
This substantiates previous mutagenesis studies, which demonstrated that repulsive interactions and/or lack of productive electrostatic interactions between Glu39 and Glu192 of thrombin and PAI-1 are responsible for the slow reaction of thrombin with this serpin.
Electrostatic potentials were calculated using a Poisson-Boltzmann solver included in the GRASP program [ 31 ] . All default parameters were used.
[ 21 ] In addition, the seven AMBER* conformations were fitted with MNDO electrostatic potential (ESP) charges scaled to the 6-31G* level [ 22 23 ] and the calculations repeated (Table 3).
Much of our earlier understanding on protein-ligand interactions is based on the steric factors, electrostatic contributions, hydrophobicity, hydrogen-bond donor or acceptor capability.
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