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Physical Chemistry Chemical Physics : PCCP
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July 26, 2008
Solvation free energies of molecules. The most stable anionic tautomers of uracil
Maciej Haranczyk, Maciej Gutowski, Arieh Warshel
Environmental Science & Technology
|
August 30, 2008
How do the partitioning properties of polyhalogenated POPs change when chlorine is replaced with bromine?
Tomasz Puzyn, Noriyuki Suzuki, Maciej Haranczyk
Journal of Molecular Graphics & Modelling
|
April 8, 2016
Towards accurate porosity descriptors based on guest-host interactions
Dooam Paik, Maciej Haranczyk, Jihan Kim
Chemical Communications (Cambridge, England)
|
October 24, 2024
Prediction of mechanical and flame-retardant properties of MOF-loaded polymer composites
Junchen Xiao, Maciej Haranczyk, De-Yi Wang
Environmental Pollution (Barking, Essex : 1987)
|
July 13, 2010
On enumeration of congeners of common persistent organic pollutants
Maciej Haranczyk, Tomasz Puzyn, Esmond G Ng
Journal of Chemical Theory and Computation
|
November 22, 2015
Discovery of Most Stable Structures of Neutral and Anionic Phenylalanine through Automated Scanning of Tautomeric and Conformational Spaces
Zibo G Keolopile, Maciej Gutowski, Maciej Haranczyk
Journal of Chemical Information and Modeling
|
May 2, 2009
Comparison of nonbinary similarity coefficients for similarity searching, clustering and compound selection
Aysha Al Khalifa, Maciej Haranczyk, John Holliday
Journal of Chemical Information and Modeling
|
November 22, 2011
Addressing challenges of identifying geometrically diverse sets of crystalline porous materials
Richard Luis Martin, Berend Smit, Maciej Haranczyk
Journal of Chemical Theory and Computation
|
December 7, 2018
Toward Automated Tools for Characterization of Molecular Porosity
Ismael Gómez García, Marco Bernabei, Maciej Haranczyk
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
March 21, 2009
Are mixed explicit/implicit solvation models reliable for studying phosphate hydrolysis? A comparative study of continuum, explicit and mixed solvation models
Shina C L Kamerlin, Maciej Haranczyk, Arieh Warshel
Page
of 8
Search research articles
Search
Showing results (11-20 of 77) with videos related to
Sort By:
Page
of 8
Physical Chemistry Chemical Physics : PCCP
|
July 26, 2008
Solvation free energies of molecules. The most stable anionic tautomers of uracil
Maciej Haranczyk, Maciej Gutowski, Arieh Warshel
Environmental Science & Technology
|
August 30, 2008
How do the partitioning properties of polyhalogenated POPs change when chlorine is replaced with bromine?
Tomasz Puzyn, Noriyuki Suzuki, Maciej Haranczyk
Journal of Molecular Graphics & Modelling
|
April 8, 2016
Towards accurate porosity descriptors based on guest-host interactions
Dooam Paik, Maciej Haranczyk, Jihan Kim
Chemical Communications (Cambridge, England)
|
October 24, 2024
Prediction of mechanical and flame-retardant properties of MOF-loaded polymer composites
Junchen Xiao, Maciej Haranczyk, De-Yi Wang
Environmental Pollution (Barking, Essex : 1987)
|
July 13, 2010
On enumeration of congeners of common persistent organic pollutants
Maciej Haranczyk, Tomasz Puzyn, Esmond G Ng
Journal of Chemical Theory and Computation
|
November 22, 2015
Discovery of Most Stable Structures of Neutral and Anionic Phenylalanine through Automated Scanning of Tautomeric and Conformational Spaces
Zibo G Keolopile, Maciej Gutowski, Maciej Haranczyk
Journal of Chemical Information and Modeling
|
May 2, 2009
Comparison of nonbinary similarity coefficients for similarity searching, clustering and compound selection
Aysha Al Khalifa, Maciej Haranczyk, John Holliday
Journal of Chemical Information and Modeling
|
November 22, 2011
Addressing challenges of identifying geometrically diverse sets of crystalline porous materials
Richard Luis Martin, Berend Smit, Maciej Haranczyk
Journal of Chemical Theory and Computation
|
December 7, 2018
Toward Automated Tools for Characterization of Molecular Porosity
Ismael Gómez García, Marco Bernabei, Maciej Haranczyk
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
March 21, 2009
Are mixed explicit/implicit solvation models reliable for studying phosphate hydrolysis? A comparative study of continuum, explicit and mixed solvation models
Shina C L Kamerlin, Maciej Haranczyk, Arieh Warshel
Page
of 8