Sentence examples for molecule is retrieved from inspiring English sources

The probability that a molecule is retrieved given that it has already been retrieved s times is hence.

Since the current search returns m molecules, the probability that a molecule is retrieved given that it has already been retrieved s-1 times is hence.

Then, when the third search is conducted, a molecule is retrieved with probability proportional to the number of searches that have already returned that molecule.

Data fusion methods are widely used in virtual screening, and make the implicit assumption that the more often a molecule is retrieved in multiple similarity searches, the more likely it is to be active.

A particular VNC product was used in the virtual computing lab biotechnology courses only because it enables the smooth manipulation of a NCBI-developed 3D molecular visualization program, Cn3D [ 23], allowing users to rotate molecules and to highlight, remove, or add certain elements once a molecule is retrieved from a database.

Only the best pose per molecule was retrieved for the molecules of the datasets from the docking and pROC-AUC values were calculated thereof.

To accomplish the simulation, 3 LKN, a crystal structure of the HLA-B*3501 HLA-B*3501was retrieved fromoleculeotein Data Bank (PDB).

However, using different fingerprints, different (active) molecules were retrieved, which suggests the use of orthogonal fingerprints individually in virtual screenings.

Total five molecules were retrieved with good docking scores and good binding interactions within the active site of WT and mutated ROS-1.

Fourteen first line drugs active against Mtb from a review [53] were used to demonstrate that the molecules are retrieved first and that similar molecules are in the top positions (Table 2).

Additional molecules were retrieved from the Fragment-Like subset to enrich the training set in underrepresented types of bonds (based on atom types of the bond, atom types of neighbors and bond orders).