Sökning: "reactivity descriptors"
Hittade 2 avhandlingar innehållade orden reactivity descriptors.
1. Computational Studies of Chemical Interactions: Molecules, Surfaces and Copper Corrosion
Sammanfattning : The chemical bond – a corner stone in science and a prerequisite for life – is the focus of this thesis. Fundamental and applied aspects of chemical bonding are covered including the development of new computational methods for the characterization and rationalization of chemical interactions. LÄS MER
2. Novel Bioinformatics Applications for Protein Allergology, Genome-Wide Association and Retrovirology Studies
Sammanfattning : Recently, the pace of growth in the amount of data sources within Life Sciences has increased exponentially until pose a difficult problem to efficiently manage their integration. The data avalanche we are experiencing may be significant for a turning point in science, with a change of orientation from proprietary to publicly available data and a concomitant acceptance of studies based on the latter. LÄS MER