scholarly article | Q13442814 |
P356 | DOI | 10.1063/1.5052551 |
P698 | PubMed publication ID | 30441927 |
P50 | author | Anna Krylov | Q55212 |
Vijay Pande | Q3558243 | ||
Robert J. Harrison | Q7345904 | ||
Cecilia Clementi | Q47328383 | ||
Teresa Head-Gordon | Q56249701 | ||
Daniel Crawford | Q58685790 | ||
Theresa L. Windus | Q64962618 | ||
Daniel G A Smith | Q88713697 | ||
Doaa Altarawy | Q90630405 | ||
Jessica A Nash | Q93154190 | ||
P2093 | author name string | Shantenu Jha | |
Taylor Barnes | |||
Benjamin Pritchard | |||
Paul Saxe | |||
Eliseo Marin-Rimoldi | |||
P2860 | cites work | pE-DB: a database of structural ensembles of intrinsically disordered and of unfolded proteins | Q24567790 |
SHIFTX2: significantly improved protein chemical shift prediction | Q24604571 | ||
P433 | issue | 18 | |
P921 | main subject | computational chemistry | Q369472 |
P304 | page(s) | 180901 | |
P577 | publication date | 2018-11-01 | |
P1433 | published in | Journal of Chemical Physics | Q900472 |
P1476 | title | Perspective: Computational chemistry software and its advancement as illustrated through three grand challenge cases for molecular science | |
P478 | volume | 149 |
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