Words similar to waals
Example sentences for: waals
How can you use “waals” in a sentence? Here are some example sentences to help you improve your vocabulary:
One hundred steps of energy minimization of the protein-ligand-water complex were initially performed, followed by 10 ps MD simulation at 300 K, with an atom-based shifted distance-dependent dielectric constant, ε = 4r; a switch function on van der Waals interaction, and a time step of 1 femtosecond (fs).
vdWC = van der Waals Clash
As a result, the binding energy function has an accuracy of 2.5 kcal/mol, but does not account for potential Van der Waals clashes.
5 [ 4 ] . Three binding energy terms were taken into account in the docking step: the van der Waals interaction represented as a Lennard-Jones 12-6 dispersion/repulsion term, the hydrogen bonding represented as a directional 12-10 term, and the Coulombic electrostatic potential.
On the other hand, the very high Van der Waals repulsions calculated Table 1(bottom) for alpha4-beta4 and alpha7-alpha7 are a clear indication of a steric clash (Figure 5D): the ligand fits next to Ala 135 of beta2, but cannot accommodate Leu 135 of beta4.