Sentence examples for reaction prediction from inspiring English sources

In this work, the Purdue Ontology for Pharmaceutical Engineering (POPE) was used to develop an excipient reaction prediction application that made use of structural, material and environmental information to predict reactions.

LaBute, M. X. et al. Adverse drug reaction prediction using scores produced by large-scale drug-protein target docking on high-performance computing machines.

Recent developments for retrosynthetic reaction prediction [30 32] even allow for the inference of unknown reactions.

Discriminating biochemical structure transformation patterns is an initial step toward reaction prediction.

In addition, we aim to extract biochemical features contributing to the reaction prediction.

Having confirmed the usefulness of our method, we conducted a comprehensive reaction prediction for all possible compound pairs.

Neuhauser, D. et al. State-to-state rates for the D + H2(v = 1, j = 1) → HD v',j') + H reaction: predictions and measurements.

Scroll down to see a round-up of HuffPost bloggers' reactions, predictions, I-told-you-so's, and more.

This paper presents modeling of a coal gasification reaction, and prediction of gasification performance for an entrained flow coal gasifier.

Adaptability controls the space between reaction and prediction, providing an inherent ability to respond efficiently to a wide range of potential challenges-not just those that are known or anticipated-as they arise in their environment.

It is highly important to understand the influences of different solvent and dispersion models on the structures, frequencies and energies of transition metal complexes because an accurateness of <0.1 kcal/mol is needed for a reasonable reaction mechanism prediction.