The 5th Annual UB CDSE Days are starting today and will have interesting events (workshops, keynote lectures, talks, symposia, etc) throughout the week. Exciting things to come!
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Archives for News
Johannes at the 2019 Data Science in Materials Workshop in Houston, TX
Johannes is currently in Houston (TX) for the 2019 Data Science in Materials Workshop. Tomorrow morning, he will give an invited talk titled “How to Make Data Science Work in the Chemical and Materials Domain”.
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Mojtaba and Johannes at the 257th ACS National Meeting in Orlando, FL
Mojtaba and Johannes are currently in Orlando (FL) for the 257th ACS National Meeting. Mojtaba will present a talk titled “A Novel Active Learning Approach for Deep Learning of Chemical Data: Extracting More Chemical Insights by Choosing Less” (CINF 73) in the CINF Division Symposium on Deep Learning on Tuesday, and another one on Wednesday titled “Advancing Molecular Feature Representation and Machine Learning Design Methodologies Using the ChemML Program Suite” (PHYS 299) in the PHYS Division Symposium on on Sustainable Software for Computational Molecular Science. Johannes will present on “Modeling, Virtual High-Throughput Screening, and Machine Learning of Deep Eutectic Solvents”
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Latest paper is now online
Our latest paper (publication #29) titled “Advances of Machine Learning in Molecular Modeling and Simulation” is now online at Current Opinion in Chemical Engineering, and you can find it here. Congrats to Mojtaba and Johannes!
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Milestones, News, and Publications.
Johannes at the FAIR Chemical Data Publishing Workshop in Orlando, FL
Johannes is currently in Orlando (FL) where he is an invited participant of the 2019 NSF OAC Workshop on FAIR Publishing Guidelines for Spectral Data and Chemical Structures .
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Vigneshwar’s last day in Buffalo
Today was another day of pride, joy, and a good dose of sadness: After being a member of the group since December 2015, Vigneshwar had his last day in Buffalo! Vigneshwar defended his MSc thesis in January 2018, wrapped up his project over the past few months, and then kept volunteering to help out the group. Tomorrow, he will head back to India for the next chapter of his career, i.e., to start work in the chemical engineering industry. During his graduate studies, Vigneshwar has been working on the modeling and discovery of biodegradable polymers and their decay reaction mechanisms.
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Graduation, Milestones, News, and Team.
Johannes at the University of Memphis
Johannes is currently in Memphis (TN) visiting the University of Memphis Department of Chemistry. He will give a seminar titled “Machine Learning the Structure-Property Relationships that Define Chemistry” later today.
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News.
Johannes invited to FOPAM conference in Raleigh, NC
Johannes was invited as a panelist in the Session on Computational Materials Design during this year’s “Foundations of Process Analytics and Machine learning” (FOPAM) conference, which will be held on August 5-9 in Raleigh, North Carolina.
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Mojtaba accepted to NSF FAIR Hackathon in Alexandria, VA
Mojtaba has been selected to participate in the NSF FAIR Hackathon being held on February 27-28 in Alexandria, VA. Congrats, Mojtaba!
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Johannes invited to CACHE conference in Breckenridge, CO
Johannes has been selected as one of the outstanding young chemical engineering educators invited to attend the CACHE conference “The Future of Cyber-Assisted Chemical Engineering Education”, which will be held July 19-20 in Breckenridge, Colorado. It will mark the 50th Anniversary of the founding of CACHE (Computer Aids for Chemical Engineering).
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