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Jayashrita Debnath
14
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Online (14)
Mediatypes
Articles (Online) (7)
OpenAccess-fulltext (7)
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1
A Cu(ii) pseudopeptide complex: a surrogate to a formal Cu(..:
Eerlapally, Raju
;
Vechalapu, Sai Kumari
;
Duraisamy, Santosh
...
Inorganic Chemistry Frontiers. , 2024
Link:
https://doi.org/10.1039/..
?
2
Kinetics of Drug Release from Clay Using Enhanced Sampling ..:
Borrego-Sánchez, Ana
;
Debnath, Jayashrita
;
Parrinello, Michele
Pharmaceutics. 14 (2022) 12 - p. 2586 , 2022
Link:
https://doi.org/10.3390/..
?
3
Computing Rates and Understanding Unbinding Mechanisms in H..:
Debnath, Jayashrita
;
Parrinello, Michele
Journal of Chemical Theory and Computation. 18 (2022) 3 - p. 1314-1319 , 2022
Link:
https://doi.org/10.1021/..
?
4
Gaussian Mixture-Based Enhanced Sampling for Statics and Dy..:
Debnath, Jayashrita
;
Parrinello, Michele
The Journal of Physical Chemistry Letters. 11 (2020) 13 - p. 5076-5080 , 2020
Link:
https://doi.org/10.1021/..
?
5
Enhanced Sampling of Transition States:
Debnath, Jayashrita
;
Invernizzi, Michele
;
Parrinello, Michele
Journal of Chemical Theory and Computation. 15 (2019) 4 - p. 2454-2459 , 2019
Link:
https://doi.org/10.1021/..
?
6
Enhanced sampling and free energy calculations with hybrid ..:
Mandal, Sagarmoy
;
Debnath, Jayashrita
;
Meyer, Bernd
.
The Journal of Chemical Physics. 149 (2018) 14 - p. , 2018
Link:
https://doi.org/10.1063/..
?
7
A database-based approach for predicting coupled cascade re..:
Debnath, Jayashrita
;
Kunnikuruvan, Sooraj
;
Sinha, Nishant
...
Molecular Simulation. 44 (2017) 7 - p. 582-589 , 2017
Link:
https://doi.org/10.1080/..
?
8
Kinetics of Drug Release from Clay Using Enhanced Sampling ..:
Ana Borrego-Sánchez
;
Jayashrita Debnath
;
Michele Parrinello
Drug Delivery and Controlled Release. , 2022
Link:
https://doi.org/10.3390/..
?
9
Kinetics of Drug Release from Clay Using Enhanced Sampling ..:
Ana Borrego-Sánchez
;
Jayashrita Debnath
;
Michele Parrinello
https://www.mdpi.com/1999-4923/14/12/2586. , 2022
Link:
https://doi.org/10.3390/..
?
10
Rare Event Dynamics:
Debnath, Jayashrita
;
id_orcid:0 000-0001-5051-4120
http://hdl.handle.net/20.500.11850/537320. , 2022
Link:
https://hdl.handle.net/2..
?
11
Kinetics of drug release from clay using enhanced sampling ..:
Borrego-Sanchez, Ana
;
Debnath, Jayashrita
;
Parrinello, Michele
http://arxiv.org/abs/2208.14099. , 2022
Link:
http://arxiv.org/abs/220..
?
12
Computing rates and understanding unbinding mechanism in ho..:
Debnath, Jayashrita
;
Parrinello, Michele
http://arxiv.org/abs/2111.07300. , 2021
Link:
http://arxiv.org/abs/211..
?
13
Gaussian Mixture Based Enhanced Sampling:
Debnath, Jayashrita
;
Parrinello, Michele
http://arxiv.org/abs/1909.07773. , 2019
Link:
http://arxiv.org/abs/190..
?
14
Enhanced sampling of transition states:
Debnath, Jayashrita
;
Invernizzi, Michele
;
Parrinello, Michele
http://arxiv.org/abs/1812.09032. , 2018
Link:
http://arxiv.org/abs/181..
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