Sasmal, Sukanya
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1

Configurational Entropy of Folded Proteins and Its Importan..:

Liu, Meili ; Das, Akshaya K. ; Lincoff, James...
International Journal of Molecular Sciences.  22 (2021)  7 - p. 3420 , 2021
 
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2

Sampling Conformational Changes of Bound Ligands Using None..:

Sasmal, Sukanya ; Gill, Samuel C. ; Lim, Nathan M..
Journal of Chemical Theory and Computation.  16 (2020)  3 - p. 1854-1865 , 2020
 
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3

Comparison of affinity ranking using AutoDock-GPU and MM-GB..:

El Khoury, Léa ; Santos-Martins, Diogo ; Sasmal, Sukanya...
Journal of Computer-Aided Molecular Design.  33 (2019)  12 - p. 1011-1020 , 2019
 
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4

D3R Grand Challenge 4: ligand similarity and MM-GBSA-based ..:

Sasmal, Sukanya ; El Khoury, Léa ; Mobley, David L.
Journal of Computer-Aided Molecular Design.  34 (2019)  2 - p. 163-177 , 2019
 
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6

Mechanism of Nucleation and Growth of Aβ40 Fibrils from All..:

Sasmal, Sukanya ; Schwierz, Nadine ; Head-Gordon, Teresa
The Journal of Physical Chemistry B.  120 (2016)  47 - p. 12088-12097 , 2016
 
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