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Journal of Computational Chemistry
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March 23, 2002
Crystal structure predictions using five space groups with two independent molecules. The case of small organic acids
Bouke P Van Eijck
Acta Crystallographica. Section B, Structural Science
|
September 28, 2005
Comparing hypothetical structures generated in the third Cambridge blind test of crystal structure prediction
Bouke P van Eijck
Journal of Computational Chemistry
|
May 27, 2022
Upack program package for crystal structure prediction: Force fields and crystal structure generation for small carbohydrate molecules
Bouke P van Eijck, Jan Kroon
Acta Crystallographica. Section B, Structural Science
|
August 1, 2002
Crystal structure prediction of small organic molecules: a second blind test
W D Sam Motherwell, Herman L Ammon, Jack D Dunitz, et al.
Acta Crystallographica. Section B, Structural Science
|
March 21, 2009
Significant progress in predicting the crystal structures of small organic molecules--a report on the fourth blind test
Graeme M Day, Timothy G Cooper, Aurora J Cruz-Cabeza, et al.
Acta Crystallographica. Section B, Structural Science
|
November 22, 2011
Towards crystal structure prediction of complex organic compounds--a report on the fifth blind test
David A Bardwell, Claire S Adjiman, Yelena A Arnautova, et al.
Acta Crystallographica Section B, Structural Science, Crystal Engineering and Materials
|
August 4, 2016
Report on the sixth blind test of organic crystal structure prediction methods
Anthony M Reilly, Richard I Cooper, Claire S Adjiman, et al.
Acta Crystallographica Section B, Structural Science, Crystal Engineering and Materials
|
October 17, 2024
The seventh blind test of crystal structure prediction: structure ranking methods
Lily M Hunnisett, Nicholas Francia, Jonas Nyman, et al.
Acta Crystallographica Section B, Structural Science, Crystal Engineering and Materials
|
October 15, 2024
The seventh blind test of crystal structure prediction: structure generation methods
Lily M Hunnisett, Jonas Nyman, Nicholas Francia, et al.
Page
of 1
Search research articles
Search
Showing results (1-10 of 9) with videos related to
Sort By:
Page
of 1
Journal of Computational Chemistry
|
March 23, 2002
Crystal structure predictions using five space groups with two independent molecules. The case of small organic acids
Bouke P Van Eijck
Acta Crystallographica. Section B, Structural Science
|
September 28, 2005
Comparing hypothetical structures generated in the third Cambridge blind test of crystal structure prediction
Bouke P van Eijck
Journal of Computational Chemistry
|
May 27, 2022
Upack program package for crystal structure prediction: Force fields and crystal structure generation for small carbohydrate molecules
Bouke P van Eijck, Jan Kroon
Acta Crystallographica. Section B, Structural Science
|
August 1, 2002
Crystal structure prediction of small organic molecules: a second blind test
W D Sam Motherwell, Herman L Ammon, Jack D Dunitz, et al.
Acta Crystallographica. Section B, Structural Science
|
March 21, 2009
Significant progress in predicting the crystal structures of small organic molecules--a report on the fourth blind test
Graeme M Day, Timothy G Cooper, Aurora J Cruz-Cabeza, et al.
Acta Crystallographica. Section B, Structural Science
|
November 22, 2011
Towards crystal structure prediction of complex organic compounds--a report on the fifth blind test
David A Bardwell, Claire S Adjiman, Yelena A Arnautova, et al.
Acta Crystallographica Section B, Structural Science, Crystal Engineering and Materials
|
August 4, 2016
Report on the sixth blind test of organic crystal structure prediction methods
Anthony M Reilly, Richard I Cooper, Claire S Adjiman, et al.
Acta Crystallographica Section B, Structural Science, Crystal Engineering and Materials
|
October 17, 2024
The seventh blind test of crystal structure prediction: structure ranking methods
Lily M Hunnisett, Nicholas Francia, Jonas Nyman, et al.
Acta Crystallographica Section B, Structural Science, Crystal Engineering and Materials
|
October 15, 2024
The seventh blind test of crystal structure prediction: structure generation methods
Lily M Hunnisett, Jonas Nyman, Nicholas Francia, et al.
Page
of 1