'Molecular properties' diaporamas de présentation

Prediction of molecular properties (I)

Prediction of molecular properties (I). The general question of rational drug design. How is the biological space (activity) of a compound connected to the chemical space (structure) ?. Is it possible to make predictions based on the molecular structure ?. ? QSAR and QSPR.

496 views • 43 slides

In Respectful Memory

John McColl Bremner 1922 - 2007. In Respectful Memory. John McColl Bremner. A heritage for Understanding Soil Nitrogen, Organic Matter and Biomass by John Pesek. John M. Bremner.

543 views • 42 slides

Prediction of molecular properties (I)

Prediction of molecular properties (I). The general question of rational drug design. Wow is the biological space (activity) of a compound connected to the chemical space (structure) ?. Is it possible to make predictions based on the molecular structure ?. ? QSAR and QSPR.

693 views • 42 slides

Outline

491 views • 36 slides

Chapter 4

Chapter 4. An introduction to molecular symmetry. 4.1 Introduction. Understanding of symmetry is essential in discussions of molecular spectroscopy and calculations of molecular properties. consider the structures of BF 3 , and BF 2 H , both of which are planar. BF bond distances

1.53k views • 36 slides

Permeability: transporting drugs through (lipid) membranes

Permeability: transporting drugs through (lipid) membranes. Paula Garcia. 1 st Physical Chemistry Symposium, November 30, 2005. Factors Determining Oral Bioavailability. Physicochemical factors:. Dissolution (solid to solution) Aqueous Solubility. Membrane Permeability.

863 views • 34 slides

ADF2007.01 The universal density functional package for chemists

ADF2007.01 The universal density functional package for chemists Prof. Mauro Stener (Trieste University) stener@univ.trieste.it. Outline. General intro DFT ADF overview Application areas Technical features Recent developments ADF New functionality. Hierarchy of Computational Methods.

424 views • 31 slides

ADF2007.01 The universal density functional package for chemists

ADF2007.01 The universal density functional package for chemists Prof. Mauro Stener (Trieste University) stener@univ.trieste.it. Outline. General intro DFT ADF overview Application areas Technical features Recent developments ADF New functionality. Hierarchy of Computational Methods.

320 views • 31 slides

Chapter 16 Thermal properties of matter

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Being and Time

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357 views • 22 slides

Lecture 25: VSEPR

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Jaguar in the Real World

Jaguar in the Real World. Used in national labs, i ndustrial companies, and academic institutions worldwide Application areas include pharmaceutical, chemical, biotechnology, agrochemical, petrochemical, aerospace, automotive, polymer, cosmetic, and materials research. Jaguar Capabilities.

317 views • 17 slides

Video Games and Learning

Video Games and Learning. ICS 62, April 22, 2014. Three perspectives on games and learning. The class last week: game enthusiasts asking, why are games so engaging to me? Shaffer: education researcher asking, what is the context in which knowledge is acquired?

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Ch 24 pages 625-627

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Ch 10 Pages 530-538; 541-554

217 views • 14 slides