第1天 | 第2天

此历程聚焦于创药领域信息学方法的技术创新。加上属于组织的研究人员和个人的研究人员从蒐集无数数据之生物医学关系数据的不同区块间能安全共享基础设施和工具，收集与生物学研究有关的各种知识，介绍在高柔性数据挖掘/分析应用中总括性的软件和算法。

10月12日

13:00 Conference Registration

创药的共同作业

Sponsored by
14:00 Chairperson’s Remarks

Yuriy Gankin, Ph.D., CSO, GGA Software Services LLC

14:05 Library Enhancement through the Wisdom of Crowds

Dimitris K. Agrafiotis, Vice President, Informatics, Johnson & Johnson Pharmaceutical Research & Development

We present a novel approach for enhancing the diversity of a chemical library rooted on the theory of the wisdom of crowds. Our approach was motivated by a desire to tap into the collective experience of our global medicinal chemistry community and involved the application of chemoinformatics techniques followed by community voting to select the most appropriate chemotypes. The solution was deployed as a plugin to 3DX, a powerful data analysis and visualization platform used by more than 1,000 scientists across J&J to support discovery, clinical, and translational research.

14:35 Collaborative Virtual Organization & Infrastructure for Anti-Malarial Drug Design

Barry Hardy, Ph.D., Project Coordinator, Scientists Against Malaria and SYNERGY

The Scientists Against Malaria consortium is a virtual drug discovery organization collaborating on target selection and modeling, protein expression and assay development, computational drug design, and screening. Supported by developments on the EU FP7 funded SYNERGY and OpenTox projects, a combination of interoperable information systems, ontologies and web services were designed and deployed to manage the data, documents, computational and assay results, activity and toxicology predictions, as well as dashboards to track project progress and to support decision making.

15:05 Integrated Decision Support for Drug Safety Assessment

Ola Spjuth, Ph.D., Researcher, Pharmaceutical Biosciences, Uppsala University, Sweden; Project Leader, Bioclipse

The Bioclipse Decision Support system is a free and open source solution developed as a collaboration between the Department of Pharmaceutical Biosciences at Uppsala University, Sweden, and the Computational Toxicology group at AstraZeneca R&D, M闤ndal, Sweden. This talk presents a general framework for building and deploying predictive in silico models, demonstrated on drug safety data. The result is a decision support system capable of running local and remote models with interpretable results, and we here present our recent developments.

15:35 Refreshment Break - Networking with Sponsors

16:15 Sponsored Presentations (Opportunities Available)

16:45 Towards a Brokering Framework for Knowledge-Based Services: Learning from the Pistoia Alliance SESL Pilot

Ian Harrow, Pistoia Alliance

This presentation describes a pilot project to determine the feasibility of biomedical knowledge brokering. It shows query across multiple disparate data sources through a brokering demonstrator built from RDF triple store technology. The learning from this pilot is contributing to larger scale projects such as the Innovative Medicines Initiative, OpenPFACTs.

17:15 Sponsored Presentation (Opportunity Available)