Bulletin of the American Physical Society
APS March Meeting 2019
Volume 64, Number 2
Monday–Friday, March 4–8, 2019; Boston, Massachusetts
Session B21: Exploring Free Energy Landscapes in Biology and Materials Science I
11:15 AM–2:15 PM,
Monday, March 4, 2019
BCEC
Room: 157B
Sponsoring
Units:
DCOMP DBIO DMP GSOFT
Chair: Pratyush Tiwary, University of Maryland, College Park
Abstract: B21.00008 : Learning reaction coordinate on-the-fly for sampling complex biomolecular systems with SGOOP and metadynamics
1:03 PM–1:15 PM
Presenter:
Debabrata Pramanik
(Chemistry and Biochemistry and Institute for Physical Science and Technology, University of Maryland, College Park, USA)
Authors:
Debabrata Pramanik
(Chemistry and Biochemistry and Institute for Physical Science and Technology, University of Maryland, College Park, USA)
Adam Kells
(Department of Chemistry, King’s College London, United Kingdom)
Zachary Smith
(Biophysics Program and Institute for Physical Science and Technology, University of Maryland, College Park, USA)
Pratyush Tiwary
(Chemistry and Biochemistry and Institute for Physical Science and Technology, University of Maryland, College Park, USA)
Collaboration:
Debabrata Pramanik, Adam Kells, Zachary Smith, Pratyush Tiwary
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