Sentence examples for shape screening from inspiring English sources

3) Shape screening calculations: We used the 3D structures determined in the previous conformational analysis as template queries to run shape screening calculations for all the drugs included in the study using phase module from Schrödinger package.

For simplicity reasons, only the structure with the global minimum potential energy OPLS_2005 was retained and used as a template in the shape screening step.

Shape screening generated different conformers for the rest of drugs and aligned them to each template to identify common pharmacophoric features between each pair of drugs.

We used the EF,RIE and BEDROC in the each of the VS protocols and in the data fusion algorithms such as sum score, sum rank and reciprocal rank and found that reciprocal rank outperformed all of the VS protocols such as pharmacophore search, shape screening and docking and as well as related to other algorithms.

The flat-tyre shape screen, the small metal bezel, stainless steel case and waterproofing are all the same.

First it adapts documents to whatever size or shape screen you're working on.

The pharmacophore model was created with the same queries that were used for shape based screening.

On www.agentprovocateur.com -- the company's Web site -- a keyhole-shape screen shows women in lingerie and masks stripping off each other's clothing, and a model in a bra with strategically placed cutouts being spanked by her girlfriends, while phrases like "Nobody will recognize me in this disguise" and "I've tried to stop but I just can't help myself" alternate with the images.

Many studies enhance thermal performance by using various groove shapes, screen mesh, and mixed structures as wick.

Carved cloud shapes screen light fixtures to create an indirect lighting effect as the viewer approaches the wooden, brass knobbed entry doors.

Single and double-size beds in aquatic hues are arranged as if on a theatrical stage, encouraging viewers to lie down and look up at the two large, organically shaped screens mounted on the ceiling.