Table 1 Program of the School of Cheminformatics in Latin America
Speaker, Affiliation, Country | Title | |
|---|---|---|
Day 1 | Alexandre Varnek University of Strasbourg, France | Chemography concept in chemical space analysis |
Matthias Rarey University of Hamburg, Germany | Beyond screening: cheminformatics for billion-sized make-on-demand compound catalogs | |
Johannes Kirchmair University of Vienna, Austria | Cheminformatics in natural product-based drug discovery | |
Round table: Rajarshi Guha Karina Martinez Mayorga José Luis Medina Franco Matthias Rarey Alexander Tropsha Barbara Zdrazil Austria–Germany–Mexico–USA | Topics: * “Dos and don’ts” when writing a paper * Where to get help/orientation to publish your work | |
Day 2 | Barbara Zdrazil & Fiona Hunter EMBL-EBI, UK | Workshop: ChEMBL—accessing big molecular data via the web interface and API |
Carolina Horta Andrade University of Goias, Brazil | Cheminformatics-driven discovery of hits for neglected and emerging diseases | |
Rajarshi Guha Vertex Pharmaceuticals, USA | Integration then interrogation: exploratory data analysis on a deadline | |
Alexander Tropsha University of North Carolina, USA | Methods and models for chemical toxicity prediction |