Cheminformatics and Open Notebook Science

Jean-Claude Bradley presents at the American Chemical Society meeting in New Orleans on April 6, 2008. The use cheminformatics tools such as SMILES, InChI, I...

Rajarshi Guha (NIH): Cloudy with a touch of Cheminformatics

Remote hosting (a.k.a. cloud computing) has become a popular topic in recent years with many vendors providing such cloud based services. The cloud enables t...

Introductory Cheminformatics - Introduction to the field

Introduction to the field of cheminformatics. For more free cheminformatics materials, see http://icep.wikispaces.com.

Cheminformatics final - SMILES tutorial.mov

A lesson in SMILES for Cheminformatics.

Cheminformatics, Graph Isomorphism & Subgraph Isomorphism

Project for Cheminformatics Fall 2012. Part 1/2. Presentation on Graph Isomorphism and Subgraph Isomorphism, and how they relate to cheminformatics. Part 2: ...

Cheminformatics Final - SYBYL.mov

SYBYL presentation.

Cheminformatics, Encodings SMILES & InChI

Project for Cheminformatics Fall 2012. Part 2/2. Presentation on encodings, SMILES and InChI. Part1: http://www.youtube.com/watch?v=Q7ZyWMgCUE4.

Zhenbin Li (Boehringer Ingelheim): Chemistry Infrastructure Migration - Concerns and Reality

Chemistry infrastructure is a crucial component in pharmaceutical R&D informatics. Because of complexity and interdependency of information systems, to migra...

Introductory Cheminformatics - 2D Chemical Structure Representation

Introduction to representation of 2D chemical structures on computer. For more free cheminformatics materials, see http://icep.wikispaces.com.

CINFWebinar 1 AlexClark

Alex Clark, Molecular Materials Informatics, Inc: In recent years smartphones and tablets have attained sufficient power and sophistication to replace conven...