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Suman Chakrabarty

s n bose national centre for basic sciences

28H指数
111论文数
1.9K被引数
收录论文 44
发表时间
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Structural heterogeneity defines the allosteric landscape and conformational selection mechanism of the PDZ2 domain结构异质性定义了PDZ2域的别构景观和构象选择机制
errPhysical Chemistry Chemical Physics
IF2.9
err2026-08-19
err0
PREAI
errSreyan Bhowmick; Krishnendu Sinha; Suman Chakrabarty Corresponding Author
err分享
err收藏
Mapping Protein-Protein Interaction Hotspots and Unveiling a Cryptic Allosteric Pocket in PLK1 PBD via Mixed-Solvent Molecular Dynamics通过混合溶剂分子动力学映射PLK1 PBD的蛋白质-蛋白质相互作用热点并揭示其隐含的别构口袋
errChemPhysChem
IF2.2
err2026-05-14
err0
PREAI
errMukhopadhyay, Sutanu; Chakrabarty, Suman
err分享
err收藏
Phosphorylation induces altered protonation states and allosterically regulates Rac1-RhoGDI complex磷酸化诱导改变的质子化状态和变构调节Rac1-RhoGDI复合物
errPROTEIN SCIENCE
IF5.2
err2025-12-22
err0
errOAAI
errSinha, Krishnendu; Kumawat, Amit; Jang, Hyunbum; Nussinov, Ruth; Chakrabarty, Suman
err分享
err收藏
PPIscout: Protein-protein interaction site hotspot mapping using mixed amino acid-water molecular dynamics simulationPPIscout：基于混合氨基酸-水分子动力学模拟的蛋白质-蛋白质相互作用位点热点映射
errJOURNAL OF CHEMICAL SCIENCES
IF2
err2025-11-26
err0
PREAI
errMukhopadhyay, Sutanu; Chakrabarty, Suman
err分享
err收藏
PathGennie: Rapid Generation of Rare Event Pathways via Direction-Guided Adaptive Sampling Using Ultrashort Monitored TrajectoriesPathGennie：通过基于方向引导自适应采样的超短监测轨迹快速生成稀有事件路径
errJournal of Chemical Theory and Computation
IF5.5
err2025-11-10
err0
PREAI
errDibyendu Maity; Shaheerah Shahid; Suman Chakrabarty
err分享
err收藏
Mixed-Solvent Molecular Dynamics Simulation Reveals a Druggable Allosteric Pocket in the PCSK9 C-Terminal Domain混合溶剂分子动力学模拟揭示了PCSK9 C末端结构域中一个可成药的别构口袋
errThe Journal of Physical Chemistry B
IF2.9
err2025-11-03
err0
PREAI
errSutanu Mukhopadhyay; Suman Chakrabarty
err分享
err收藏
Why [BMIM]+[PF6]- is hydrophobic and [BMIM]+[BF4]- hydrophilic in nature? A quantum chemical investigation为什么 [BMIM]+[PF6]− 本质上是疏水性的，而 [BMIM]+[BF4]− 是亲水性的？一项量子化学研究
errJOURNAL OF CHEMICAL SCIENCES
IF2
err2025-10-13
err1
PREAI
errAhamed, Sk. Samir; Chakrabarty, Suman; Biswas, Ranjit
err分享
err收藏
Transgenic Tobacco Plants Expressing Synthetic Peptides: A Functional and Structural Analysis for Pathogen Resistance转基因烟草植物表达合成肽：病原体抗性的功能与结构分析
errPlant Biotechnology Journal
IF10.5
err2025-09-15
err0
errOAAI
errKarishma Biswas; Sudipta Mitra; Dibakar Roy; Sanhita Roy; Dibakar Sarkar; DeokHyun Son; Rohit Das; Anuradha Roy; Dulal Senapati; Humaira Ilyas; A. Harikishore; Ranjit Biswas; Suman Chakrabarty; DongKuk Lee; Indranil Biswas; Sudipto Saha; Pallob Kundu; Anirban Bhunia
err分享
err收藏
Harnessing Allostery to Modulate Protein-Protein Interactions: From Function to Therapeutic Innovations利用别构效应调控蛋白质-蛋白质相互作用：从功能到治疗创新
errJournal of Molecular Biology
IF4.5
err2025-08-08
err0
PREAI
errSutanu Mukhopadhyay; Krishnendu Sinha; Suman Chakrabarty
err分享
err收藏
Unraveling antibody-induced mechanical stability of antigen: Insights from single-molecule studies揭示抗体诱导的抗原力学稳定性：单分子研究的见解
errProtein Science
IF5.2
err2025-06-16
err0
PREAI
errSoham Chakraborty; Shivam Pandit; Krishnendu Sinha; Madhu Bhatt; Debojyoti Chowdhury; Suman Chakrabarty; Shubhasis Haldar
err分享
err收藏
Mapping conformational landscape in protein folding: Benchmarking dimensionality reduction and clustering techniques on the Trp-Cage mini-protein蛋白质折叠中的构象景观图: trp-cage微型蛋白质上的基准降维和聚类技术
errBIOPHYSICAL CHEMISTRY
IF2.2
err2025-04-01
err0
PREAI
errBhattacharya, Sayari; Chakrabarty, Suman
err分享
err收藏
IceCoder: Identification of Ice Phases in Molecular Simulation Using Variational Autoencoder
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2025-02-11
err0
errOAAI
errMaity, Dibyendu; Chakrabarty, Suman
err分享
err收藏
WeTICA: A directed search weighted ensemble based enhanced sampling method to estimate rare event kinetics in a reduced dimensional space
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2025-01-15
err0
errOAAI
errMitra, Sudipta; Biswas, Ranjit; Chakrabarty, Suman
err分享
err收藏
Elucidating the microscopic origin of observed anti-correlation between the protein-protein and protein-water interaction energies
errCHEMICAL PHYSICS IMPACT
IF4.3
err2024-06-01
err1
errOAAI
errSinha, Krishnendu; Kumawat, Amit; Chakrabarty, Suman
err分享
err收藏
Leveraging Bidirectional Nature of Allostery To Inhibit Protein-Protein Interactions (PPIs): A Case Study of PCSK9-LDLR Interaction
errJOURNAL OF CHEMICAL INFORMATION AND MODELING
IF5.3
err2024-04-14
err2
PREAI
errSinha, Krishnendu; Basu, Ipsita; Shah, Zacharia; Shah, Salim; Chakrabarty, Suman
err分享
err收藏
Molecular mechanism of regulation of RhoA GTPase by phosphorylation of RhoGDIRhoGDI磷酸化调控RhoA gtp酶的分子机制
errBIOPHYSICAL JOURNAL
IF3.1
err2024-01-01
err2
errOAAI
errSinha, Krishnendu; Kumawat, Amit; Jang, Hyunbum; Nussinov, Ruth; Chakrabarty, Suman
err分享
err收藏
Design of CO2 Thickeners and Role of Aromatic Rings in Enhanced Oil Recovery Using Molecular Dynamics
errLANGMUIR
IF3.9
err2023-01-11
err7
PREAI
errTadepalli, Kavya Mrudula; Chakrabarty, Suman; Patil, Pramod; Kumar, Rajnish
err分享
err收藏
Efficient light harvesting in self-assembled organic luminescent nanotubes
errCHEMICAL SCIENCE
IF7.4
err2023-01-01
err9
errOAAI
errBhaumik, Shubhra Kanti; Maity, Dibyendu; Basu, Ipsita; Chakrabarty, Suman; Banerjee, Supratim
err分享
err收藏
Modulation of drug binding ability and augmented enzymatic activity of lysozyme stabilized in presence of surface-active ionic liquids
errJOURNAL OF MOLECULAR LIQUIDS
IF5.2
err2022-12-01
err3
PREAI
errRay, Dhiman; Singh, Imocha Rajkumar; Bhatta, Anindita; Das, Abhinandan; Chakrabarty, Suman; Mitra, Sivaprasad
err分享
err收藏
Traceless cysteine-linchpin enables precision engineering of lysine in native proteins无痕半胱氨酸-关键蛋白可实现天然蛋白质中赖氨酸的精确工程
errNATURE COMMUNICATIONS
IF15.7
err2022-10-13
err20
errOAAI
errReddy, Neelesh C.; Molla, Rajib; Joshi, Pralhad Namdev; Sajeev, T. K.; Basu, Ipsita; Kawadkar, Jyotsna; Kalra, Neetu; Mishra, Ram Kumar; Chakrabarty, Suman; Shukla, Sanjeev; Rai, Vishal
err分享
err收藏

研究方向

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合作学者
合作期刊
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Ruth Nussinov
H 指数: 131 · 论文数: 1.2K
A
Arieh Warshel
H 指数: 123 · 论文数: 594
D
Dipak K. Das
H 指数: 90 · 论文数: 722
P
Pramod S. Patil
H 指数: 84 · 论文数: 664
B
Biman Bagchi
H 指数: 69 · 论文数: 702
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