From Macromolecules to Electrons - Grand Challenges in Theoretical and Computational Chemistry
| Main Author: | |
|---|---|
| Format: | Article |
| Language: | English |
| Published: |
Frontiers Media S.A.
2013-05-01
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| Series: | Frontiers in Chemistry |
| Subjects: | |
| Online Access: | http://journal.frontiersin.org/Journal/10.3389/fchem.2013.00006/full |
| _version_ | 1811327266284634112 |
|---|---|
| author | Thomas S. Hofer |
| author_facet | Thomas S. Hofer |
| author_sort | Thomas S. Hofer |
| collection | DOAJ |
| first_indexed | 2024-04-13T15:04:45Z |
| format | Article |
| id | doaj.art-c9f37c67137b4a52b5da548dbc4c7dc2 |
| institution | Directory Open Access Journal |
| issn | 2296-2646 |
| language | English |
| last_indexed | 2024-04-13T15:04:45Z |
| publishDate | 2013-05-01 |
| publisher | Frontiers Media S.A. |
| record_format | Article |
| series | Frontiers in Chemistry |
| spelling | doaj.art-c9f37c67137b4a52b5da548dbc4c7dc22022-12-22T02:42:12ZengFrontiers Media S.A.Frontiers in Chemistry2296-26462013-05-01110.3389/fchem.2013.0000643648From Macromolecules to Electrons - Grand Challenges in Theoretical and Computational ChemistryThomas S. Hofer0University of Innsbruckhttp://journal.frontiersin.org/Journal/10.3389/fchem.2013.00006/fullprotein folding problembiomolecular solvationlinear scalingGPU quantum algorithmsreactive force fieldsnuclear quantum effects |
| spellingShingle | Thomas S. Hofer From Macromolecules to Electrons - Grand Challenges in Theoretical and Computational Chemistry Frontiers in Chemistry protein folding problem biomolecular solvation linear scaling GPU quantum algorithms reactive force fields nuclear quantum effects |
| title | From Macromolecules to Electrons - Grand Challenges in Theoretical and Computational Chemistry |
| title_full | From Macromolecules to Electrons - Grand Challenges in Theoretical and Computational Chemistry |
| title_fullStr | From Macromolecules to Electrons - Grand Challenges in Theoretical and Computational Chemistry |
| title_full_unstemmed | From Macromolecules to Electrons - Grand Challenges in Theoretical and Computational Chemistry |
| title_short | From Macromolecules to Electrons - Grand Challenges in Theoretical and Computational Chemistry |
| title_sort | from macromolecules to electrons grand challenges in theoretical and computational chemistry |
| topic | protein folding problem biomolecular solvation linear scaling GPU quantum algorithms reactive force fields nuclear quantum effects |
| url | http://journal.frontiersin.org/Journal/10.3389/fchem.2013.00006/full |
| work_keys_str_mv | AT thomasshofer frommacromoleculestoelectronsgrandchallengesintheoreticalandcomputationalchemistry |