Archive for the ‘ACS Meetings’ Category

Spring ACS Meeting San Francisco, April 2017   Leave a comment

The Spring ACS Meeting is coming, and it’s coming quickly. Every time the New Year starts I think I have a long time before I have to assemble posters and write talks for the ACS Meeting. When I worked at the RSC it was easier in some ways as NO ONE reviewed them, no one gave […]

PRESENTATION: Building an Online Profile Using Social Networking and Amplification Tools for Scientists   Leave a comment

This presentation was given as a 2 hour hands-on training course at the Frontier Building in the Research Triangle Park in NC funded by an Industry Award Grant from the ACS and matching financial support from the Research Triangle Institute. Abstract “Many of us nowadays invest significant amounts of time in sharing our activities and […]

Programmatic conversion of crystal structures into 3D printable files using Jmol   Leave a comment

A new paper that came out of a collaboration initiated at an ACS Meeting, maybe three years ago, has finally gone online. My recollection is that at an ACS CINF reception I started chatting with Vincent Scalfani. At that time I was involved with ChemSpider and he bounced an idea about 3D printing of crystal […]

Posted November 25, 2016 by tony in ACS Meetings

The EPA iCSS Chemistry Dashboard to Support Compound Identification Using High Resolution Mass Spectrometry Data   Leave a comment

Presentation given at ACS Meeting in Philadelphia in August 2016 The EPA iCSS Chemistry Dashboard to Support Compound Identification Using High Resolution Mass Spectrometry Data There is a growing need for rapid chemical screening and prioritization to inform regulatory decision-making on thousands of chemicals in the environment. We have previously used high-resolution mass spectrometry to […]

My NC-ACS Distinguished Speaker Award Presentation   Leave a comment

Last night I was honored to receive an award from the North Carolina Local Section of the American Chemical Society. I had the chance to review the past 20 years of my career with the attendees. I assembled a slide deck from about ten years of slides stored on Slideshare (I am glad I have been […]

Call For Papers: Applications of Cheminformatics and Computational Chemistry in Environmental Health   Leave a comment

CALL FOR PAPERS Applications of Cheminformatics and Computational Chemistry in Environmental Health  253rd American Chemical Society National Meeting & Exposition “Advanced Materials, Technologies, Systems & Processes” San Francisco, California, April 2-6, 2017 Abstract Deadline: October 2016   Cheminformatics and computational chemistry have had an enormous impact in regards to providing environmental chemists and toxicologists access to […]

Posted September 12, 2016 by tony in ACS Meetings, Chemicals and our Health

The EPA Online Prediction Physicochemical Prediction Platform to Support Environmental Scientists   Leave a comment

This poster was presented at the American Chemical Society in Philadelphia in August 2016 at the Sci-Mix gathering and at the ENVR section on Wednesday. SESSION: Sci-Mix SESSION TIME: August 22, 2016 from 8:00 PM to 10:00 PM and SESSION TIME: Wednesday, August, 24, 2016, 6:00 PM – 8:00 PM ROOM & LOCATION: Hall D – […]

Investigating Impact Metrics for Performance for the US-EPA National Center for Computational Toxicology   Leave a comment

This presentation was presented at the American Chemical Society in Philadelphia in August 2016 DAY & TIME OF PRESENTATION: Sunday, August, 21, 2016 from 4:10 PM – 4:30 PM ROOM & LOCATION: Room 112B – Pennsylvania Convention Center Title: Investigating Impact Metrics for Performance for the US-EPA National Center for Computational Toxicology The U.S. Environmental […]

Structure Identification Using High Resolution Mass Spectrometry Data and the EPA’s Chemistry Dashboard   Leave a comment

This presentation was presented at the American Chemical Society in Philadelphia in August 2016 DAY & TIME OF PRESENTATION: Sunday, August, 21, 2016 from 1:10 PM – 1:35 PM ROOM & LOCATION: Room 105A – Pennsylvania Convention Center Title: Structure Identification Using High Resolution Mass Spectrometry Data and the EPA’s Chemistry Dashboard The iCSS Chemistry […]

Presentations and Posters at #ACSPhiladelphia August 2016   Leave a comment

I will be delivering five presentations and a poster (twice) at the ACS Meeting in Philadelphia this week. These presentations will introduce the latest version of our CompTox Dashboard, renamed from the iCSS Chemistry Dashboard because now we are offering way more than just a large set of chemical structures! I look forward to introducing […]

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