E-LIB Suche - Ergebnisse für: Dharuman, Gautham

1

Machine Learning-Driven Multiscale Modeling: Bridging the S..:

Ingólfsson, Helgi I. ; Bhatia, Harsh ; Aydin, Fikret...
Journal of Chemical Theory and Computation. 19 (2023) 9 - p. 2658-2675 , 2023

Link: https://doi.org/10.1021/..

2

Predicting membrane orientational states of RAS and RAS-RAF..:

Aydin, Fikret ; Georgouli, Konstantia ; Dharuman, Gautham...
Biophysical Journal. 122 (2023) 3 - p. 506a , 2023

Link: https://doi.org/10.1016/..

3

Protein Generation via Genome-scale Language Models with Bi..:

, In: Proceedings of the SC '23 Workshops of The International Conference on High Performance Computing, Network, Storage, and Analysis,

Dharuman, Gautham ; Ward, Logan ; Ma, Heng... - p. 95-101 , 2023

Link: https://dl.acm.org/doi/1..

4

Sarkas: A fast pure-python molecular dynamics suite for pla..:

Silvestri, Luciano G. ; Stanek, Lucas J. ; Dharuman, Gautham..
Computer Physics Communications. 272 (2022) - p. 108245 , 2022

Link: https://doi.org/10.1016/..

5

Machine learning–driven multiscale modeling reveals lipid-d..:

Ingólfsson, Helgi I. ; Neale, Chris ; Carpenter, Timothy S....
Proceedings of the National Academy of Sciences. 119 (2022) 1 - p. , 2022

Link: https://doi.org/10.1073/..

6

Machine-learning-based dynamic-importance sampling for adap..:

Bhatia, Harsh ; Carpenter, Timothy S. ; Ingólfsson, Helgi I....
Nature Machine Intelligence. 3 (2021) 5 - p. 401-409 , 2021

Link: https://doi.org/10.1038/..

7

Capturing Biologically Complex Tissue-Specific Membranes at..:

Ingólfsson, Helgi I. ; Bhatia, Harsh ; Zeppelin, Talia...
The Journal of Physical Chemistry B. 124 (2020) 36 - p. 7819-7829 , 2020

Link: https://doi.org/10.1021/..

8

High-frequency response of classical strongly coupled plasm..:

Choi, Yongjun ; Dharuman, Gautham ; Murillo, Michael S.
Physical Review E. 100 (2019) 1 - p. , 2019

Link: https://doi.org/10.1103/..

9

A massively parallel infrastructure for adaptive multiscale..:

, In: Proceedings of the International Conference for High Performance Computing, Networking, Storage and Analysis,

Di Natale, Francesco ; Bhatia, Harsh ; Carpenter, Timothy S.... - p. 1-16 , 2019

Link: https://dl.acm.org/doi/1..

10

Bump-on-tail instability across coupling and interaction-ra..:

Williams, Joseph J. ; Dharuman, Gautham ; Marciante, Mathieu..
Physical Review Research. 1 (2019) 3 - p. , 2019

Link: https://doi.org/10.1103/..

11

Controllable non-ideal plasmas from photoionized compressed..:

Dharuman, Gautham ; Stanton, Liam G ; Murillo, Michael S
New Journal of Physics. 20 (2018) 10 - p. 103010 , 2018

Link: https://doi.org/10.1088/..

12

A generalized Ewald decomposition for screened Coulomb inte..:

Dharuman, Gautham ; Stanton, Liam G. ; Glosli, James N..
The Journal of Chemical Physics. 146 (2017) 2 - p. , 2017

Link: https://doi.org/10.1063/..

13

Modeling and simulation of an ultrasensitive electron tunne..:

Fan, Zheng ; Tao, Xinyong ; Dharuman, Gautham..
RSC Advances. 6 (2016) 10 - p. 8297-8302 , 2016

Link: https://doi.org/10.1039/..

14

Atomic bound state and scattering properties of effective m..:

Dharuman, Gautham ; Verboncoeur, John ; Christlieb, Andrew.
Physical Review E. 94 (2016) 4 - p. , 2016

Link: https://doi.org/10.1103/..

15

Internal Electron Tunneling Enabled Ultrasensitive Position..:

Tao, Xinyong ; Fan, Zheng ; Nelson, Bradley J....
Nano Letters. 15 (2015) 11 - p. 7281-7287 , 2015

Link: https://doi.org/10.1021/..