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Maxmin distance sort heuristic-based initial centroid method of partitional clustering for big data mining

Pattern analysis and applications : PAA, 2022, Vol.25 (1), p.139-156

2022

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Activation pathway of Src kinase reveals intermediate states as targets for drug design

Nature communications, 2014-03, Vol.5 (1), p.3397-3397, Article 3397

2014

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Min–max kurtosis mean distance based k-means initial centroid initialization method for big genomic data clustering

Evolutionary intelligence, 2023-06, Vol.16 (3), p.1055-1076

2023

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Degradation of complex arabinoxylans by human colonic Bacteroidetes

Nature communications, 2021-01, Vol.12 (1), p.459-459, Article 459

2021

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Stratified linear systematic sampling based clustering approach for detection of financial risk group by mining of big data

International journal of system assurance engineering and management, 2022-06, Vol.13 (3), p.1239-1253

2022

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Engineered ACE2 decoy mitigates lung injury and death induced by SARS-CoV-2 variants

Nature chemical biology, 2022-03, Vol.18 (3), p.342

2022

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How do antiporters exchange substrates across the cell membrane? An atomic-level description of the complete exchange cycle in NarK

Structure (London), 2021-08, Vol.29 (8), p.922-933.e3

2021

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Chiral emergence in multistep hierarchical assembly of achiral conjugated polymers

Nature communications, 2022-05, Vol.13 (1), p.2738-2738, Article 2738

2022

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Universality of the Sodium Ion Binding Mechanism in Class A G‐Protein‐Coupled Receptors

Angewandte Chemie International Edition, 2018-03, Vol.57 (12), p.3048-3053

International ed. in English, 2018

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To milliseconds and beyond: challenges in the simulation of protein folding

Current opinion in structural biology, 2013-02, Vol.23 (1), p.58-65

2013

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Recruiting machine learning methods for molecular simulations of proteins

Molecular simulation, 2018-07, Vol.44 (11), p.891-904

2018

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Cloud-based simulations on Google Exacycle reveal ligand modulation of GPCR activation pathways

Nature chemistry, 2014-01, Vol.6 (1), p.15

2014

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Structural architecture of a dimeric class C GPCR based on co-trafficking of sweet taste receptor subunits

The Journal of biological chemistry, 2019-03, Vol.294 (13), p.4759-4774

2019

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Conformational heterogeneity of the calmodulin binding interface

Nature communications, 2016-04, Vol.7 (1), p.10910-10910, Article 10910

2016

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Distinct activation mechanisms regulate subtype selectivity of Cannabinoid receptors

Communications biology, 2023-05, Vol.6 (1), p.485-485, Article 485

2023

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Challenges and opportunities in machine learning-guided plant protein engineering

Biophysical journal, 2024-02, Vol.123 (3), p.455a-455a

Shukla, Diwakar

2024

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Dynamic-template-directed multiscale assembly for large-area coating of highly-aligned conjugated polymer thin films

Nature communications, 2017-07, Vol.8 (1), p.16070-16070, Article 16070

2017

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Functional regulation of aquaporin dynamics by lipid bilayer composition

Nature communications, 2024-02, Vol.15 (1), p.1848-1848, Article 1848

2024

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Arginine and the Hofmeister Series: The Role of Ion–Ion Interactions in Protein Aggregation Suppression

The journal of physical chemistry. B, 2011-06, Vol.115 (22), p.7447-7458

2011

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Cloud computing approaches for prediction of ligand binding poses and pathways

Scientific reports, 2015-01, Vol.5 (1), p.7918-7918, Article 7918

2015

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Molecular dynamics simulations reveal the conformational dynamics of Arabidopsis thaliana BRI1 and BAK1 receptor-like kinases

The Journal of biological chemistry, 2017-07, Vol.292 (30), p.12643-12652

2017

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The Arabidopsis AtSWEET13 transporter discriminates sugars by selective facial and positional substrate recognition

Communications biology, 2024-06, Vol.7 (1), p.764-14, Article 764

2024

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A network of molecular switches controls the activation of the two-component response regulator NtrC

Nature communications, 2015-06, Vol.6 (1), p.7283-7283, Article 7283

2015

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Heat dissipation guides activation in signaling proteins

Proceedings of the National Academy of Sciences - PNAS, 2015-08, Vol.112 (33), p.10377-10382

2015

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Maxmin distance sort heuristic-based initial centroid method of partitional clustering for big data mining

Activation pathway of Src kinase reveals intermediate states as targets for drug design

Min–max kurtosis mean distance based k-means initial centroid initialization method for big genomic data clustering

Degradation of complex arabinoxylans by human colonic Bacteroidetes

Stratified linear systematic sampling based clustering approach for detection of financial risk group by mining of big data

Engineered ACE2 decoy mitigates lung injury and death induced by SARS-CoV-2 variants

How do antiporters exchange substrates across the cell membrane? An atomic-level description of the complete exchange cycle in NarK

Chiral emergence in multistep hierarchical assembly of achiral conjugated polymers

Universality of the Sodium Ion Binding Mechanism in Class A G‐Protein‐Coupled Receptors

To milliseconds and beyond: challenges in the simulation of protein folding

Recruiting machine learning methods for molecular simulations of proteins

Cloud-based simulations on Google Exacycle reveal ligand modulation of GPCR activation pathways

Structural architecture of a dimeric class C GPCR based on co-trafficking of sweet taste receptor subunits

Conformational heterogeneity of the calmodulin binding interface

Distinct activation mechanisms regulate subtype selectivity of Cannabinoid receptors

Challenges and opportunities in machine learning-guided plant protein engineering

Dynamic-template-directed multiscale assembly for large-area coating of highly-aligned conjugated polymer thin films

Functional regulation of aquaporin dynamics by lipid bilayer composition

Arginine and the Hofmeister Series: The Role of Ion–Ion Interactions in Protein Aggregation Suppression

Cloud computing approaches for prediction of ligand binding poses and pathways

Molecular dynamics simulations reveal the conformational dynamics of Arabidopsis thaliana BRI1 and BAK1 receptor-like kinases

The Arabidopsis AtSWEET13 transporter discriminates sugars by selective facial and positional substrate recognition

A network of molecular switches controls the activation of the two-component response regulator NtrC

Heat dissipation guides activation in signaling proteins

Inhibition of lung microbiota-derived proapoptotic peptides ameliorates acute exacerbation of pulmonary fibrosis

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