עקוב אחר
Navjeet Ahalawat
Navjeet Ahalawat
CCS Haryana Agricultural University, Hisar
כתובת אימייל מאומתת בדומיין hau.ac.in
כותרת
צוטט על ידי
צוטט על ידי
שנה
Molecular dynamics simulation and binding studies of β-sitosterol with human serum albumin and its biological relevance
B Sudhamalla, M Gokara, N Ahalawat, DG Amooru, R Subramanyam
The Journal of Physical Chemistry B 114 (27), 9054-9062, 2010
1752010
An ebselen like catalyst with enhanced GPx activity via a selenol intermediate
SJ Balkrishna, S Kumar, GK Azad, BS Bhakuni, P Panini, N Ahalawat, ...
Organic & biomolecular chemistry 12 (8), 1215-1219, 2014
782014
Atomic resolution mechanism of ligand binding to a solvent inaccessible cavity in T4 lysozyme
J Mondal, N Ahalawat, S Pandit, LE Kay, P Vallurupalli
PLoS computational biology 14 (5), e1006180, 2018
652018
Molecular dynamics simulation studies of betulinic acid with human serum albumin
C Malleda, N Ahalawat, M Gokara, R Subramanyam
Journal of molecular modeling 18, 2589-2597, 2012
532012
Mapping the substrate recognition pathway in cytochrome P450
N Ahalawat, J Mondal
Journal of the American Chemical Society 140 (50), 17743-17752, 2018
472018
Assessment and optimization of collective variables for protein conformational landscape: GB1 β-hairpin as a case study
N Ahalawat, J Mondal
The Journal of Chemical Physics 149 (9), 094101, 2018
262018
Activation of corticotropin-releasing factor 1 receptor: insights from molecular dynamics simulations
R Singh, N Ahalawat, RK Murarka
The Journal of Physical Chemistry B 119 (7), 2806-2817, 2015
252015
Atomistic Insights into Structural Differences between E3 and E4 Isoforms of Apolipoprotein E
A Ray, N Ahalawat, J Mondal
Biophysical Journal 113 (12), 2682–2694, 2017
172017
An appraisal of computer simulation approaches in elucidating biomolecular recognition pathways
N Ahalawat, J Mondal
The Journal of Physical Chemistry Letters 12 (1), 633-641, 2020
152020
Conformational changes and allosteric communications in human serum albumin due to ligand binding
N Ahalawat, RK Murarka
Journal of Biomolecular Structure and Dynamics 33 (10), 2192-2204, 2015
152015
Role of allosteric switches and adaptor domains in long-distance cross-talk and transient tunnel formation
N Sharma, N Ahalawat, P Sandhu, E Strauss, J Mondal, R Anand
Science Advances 6 (14), eaay7919, 2020
112020
On identifying collective displacements in apo-proteins that reveal eventual binding pathways
D Dube, N Ahalawat, H Khandelia, J Mondal, S Sengupta
PLoS computational biology 15 (1), e1006665, 2019
112019
Structural Ensemble of CD4 Cytoplasmic Tail (402-419) Reveals a Nearly Flat Free Energy Landscape with Local α-Helical Order in Aqueous Solution
N Ahalawat, S Arora, RK Murarka
The Journal of Physical Chemistry B 119 (34), 11229–11242, 2015
82015
Reconciling conformational heterogeneity and substrate recognition in cytochrome P450
BR Dandekar, N Ahalawat, J Mondal
Biophysical Journal 120 (9), 1732-1745, 2021
72021
Nonaffine displacements encode collective conformational fluctuations in proteins
DD Prakashchand, N Ahalawat, S Bandyopadhyay, S Sengupta, ...
Journal of Chemical Theory and Computation 16 (4), 2508-2516, 2020
72020
On the role of solvent in hydrophobic cavity–ligand recognition kinetics
N Ahalawat, S Bandyopadhyay, J Mondal
The Journal of Chemical Physics 152 (7), 2020
72020
Molecular Mechanism of Nucleotide-Dependent Allosteric Regulation in AMP-Activated Protein Kinase
N Ahalawat, RK Murarka
The Journal of Physical Chemistry B 121 (14), 2919-2930, 2017
42017
Structural and functional insights into the candidate genes associated with different developmental stages of flag leaf in bread wheat (Triticum aestivum L.)
S Mehla, U Kumar, P Kapoor, Y Singh, P Sihag, V Sagwal, P Balyan, ...
Frontiers in Genetics 13, 933560, 2022
22022
First Report of Klebsiella Leaf Streak on Sorghum Caused by Klebsiella variicola in Haryana, India
VK Malik, M Singh, P Sangwan, P Kumari, BL Sharma, P Kumari, P Verma, ...
Plant Disease 107 (7), 2215, 2023
12023
Markov State Models Reconcile Conformational Plasticity of GTPase with Its Substrate Binding Event
BR Dandekar, N Ahalawat, S Sinha, J Mondal
JACS Au 3 (6), 1728-1741, 2023
12023
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מאמרים 1–20