Polymorph Stability Prediction: On the Importance of Accurate Structures: A Case Study of Pyrazinamide
Author:
Affiliation:
1. Department of Chemistry, Copenhagen University, Universitetsparken 5, 2100 Copenhagen, Denmark
2. Institute of Physics, ASCR v.v.i., Cukrovarnicka 10, 162 00 Praha 6, Czech Republic
Publisher
American Chemical Society (ACS)
Subject
Condensed Matter Physics,General Materials Science,General Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/cg400800u
Reference25 articles.
1. A Major Advance in Crystal Structure Prediction
2. Ten years of experience in polymorph prediction: what next?
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4. Understanding Thermodynamic Properties at the Molecular Level: Multiple Temperature Charge Density Study of Ribitol and Xylitol
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3. Dynamics and disorder: on the stability of pyrazinamide polymorphs;Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials;2022-06-01
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