The patterns were only visible in features of smaller distances of these large molecules, indicating that only a small region of these compounds (polar atoms of all compounds) created the activity, whereas the rest of the structure is just needed to maintain the shape.
The matrix of smallest distance between each pair of amino acids showed that there were no distinct changes for all protein-ligand complexes.
This weighting factor also accounts for the supposition that an over-representation of small distance scores is more likely to reflect strong associations than an over-representation of large distance scores.
Second, a combination of a minimum sample size of 150, a design that ensures the sampling of small distances and variogram estimation by residual maximum likelihood offers a good compromise between accuracy and efficiency.
For example, Weiss et al. gains much of its power by only attempting to preserve the relative order of small distances.
The simulated model that best fitted our autosomal data was defined as that giving the highest proportion of small distances between the simulated and observed summary statistics, S' and S.
To take the structure of the data into account, an additional term is introduced in the likelihood, which encourages the preservation of small distances of data points from the same developmental stage (i.e. 2-cell stage, 4-cell stage,..., 64-cell stage).
Dense regions correspond to small values of F 2 j − 1 N (x i, j P ) so that Eq. 4 leads to the right value of p j N (x i, j P ) in the limit of small distances, that is p j N (x i, j P ) = F 2 j − 1 N (x i, j P ).
Although, in classical pharmacokinetics that involves macroscopic compartments, this concept represents a crude approximation, in SBSP, it belongs to plausible assumptions, because of small distances that the molecules of chemicals must cross in the subcellular compartments (more details are given in section ).
Overall, we find that increasing the number of recommendations leads to smaller distances in the recommendation networks.
Most likely, this increase is caused by a field-enhancement because of the smaller distance between the two striplines at this position.
