APS March Meeting 2020 Presentations

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APS March Meeting 2020

Session L

L45.00006: Linearized machine learning potential with high-order rotational polynomial invariants for multi-component systems
Sponsor Unit(s): DCOMP GDS DSOFT DPOLY
Atsuto Seko, Isao Tanaka

L45.00013: Hunting FOX: Using Fragments to Sniff Out Drug Leads for Antibiotic Discovery
Sponsor Unit(s): DCOMP GDS DSOFT DPOLY
Rachael Mansbach, Inga Leus, Jitender Mehla, Cesar Lopez, John Walker, Valentin Rybenkov, Nicolas Hengartner, Helen Zgurskaya, S Gnanakaran