AZD8329
/ AstraZeneca
- LARVOL DELTA
Home
Next
Prev
1 to 3
Of
3
Go to page
1
April 14, 2022
De Novo Crystal Structure Determination from Machine Learned Chemical Shifts.
(PubMed, J Am Chem Soc)
- "Solid-state NMR chemical shifts can be used to solve this problem, but they are limited by the high computational cost associated with crystal structure prediction methods and density functional theory chemical shift calculations. Here, we successfully determine the crystal structures of ampicillin, piroxicam, cocaine, and two polymorphs of the drug molecule AZD8329 using on-the-fly generated machine-learned isotropic chemical shifts to directly guide a Monte Carlo-based structure determination process starting from a random gas-phase conformation."
Journal
March 14, 2011
To assess the safety, tolerability, pharmacokinetics and pharmacodynamics of oral administration of AZD8329 (AZ8329)
(clinicaltrials.gov)
-
AZ; P1; N=45
Diabetes
February 13, 2020
Chemical shift based NMR crystallography of molecular crystals
(ACS-Sp 2020)
- "The figure shows the full three-dimensional structure determined by NMR for a powder sample of the drug molecule AZD8329. The positional errors are visualized as ORTEP plots drawn at the 90% probability level."
1 to 3
Of
3
Go to page
1