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TITLE: Artificial Intelligence-Driven Modeling for Hydrogel Three-Dimensional Printing: Computational and Experimental Cases of Study  Full Text
AUTHORS: Bediaga Baneres, Harbil; Moreno Benitez, Isabel; Arrasate, Sonia; Perez alvarez, Leyre; Halder, Amit K. ; Cordeiro, M. Natalia D. S.; Gonzalez Diaz, Humberto; Vilas Vilela, Jose Luis;
PUBLISHED: 2025, SOURCE: POLYMERS, VOLUME: 17, ISSUE: 1
INDEXED IN: Scopus WOS CrossRef
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TITLE: Machine learning-driven prediction of deep eutectic solvents’ heat capacity for sustainable process design
AUTHORS: Amit Kumar Halder ; Reza Haghbakhsh; Elisabete C Ferreira ; Ana Rita Duarte; Natália D S Cordeiro;
PUBLISHED: 2025, SOURCE: Journal of Molecular Liquids, VOLUME: 418
INDEXED IN: Scopus CrossRef
IN MY: ORCID
3
TITLE: AI Driven Modelling for Hydrogel 3D-Printing: Computational and Experimental Cases of Study
AUTHORS: Harbil Bediaga-Bañeres; Isabel Moreno-Benítez; Sonia Arrasate; Leyre Pérez-Álvarez; Amit K Halder ; Natalia N D S Cordeiro; Humberto González-Díaz; José Luis Vilas-Vilela;
PUBLISHED: 2024
INDEXED IN: CrossRef
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TITLE: Shaping the Future of Obesity Treatment: In Silico Multi-Modeling of IP6K1 Inhibitors for Obesity and Metabolic Dysfunction  Full Text
AUTHORS: Mondal, Ismail; Halder, Amit Kumar ; Pattanayak, Nirupam; Mandal, Sudip Kumar; Cordeiro, Maria Natalia D. S. ;
PUBLISHED: 2024, SOURCE: PHARMACEUTICALS, VOLUME: 17, ISSUE: 2
INDEXED IN: Scopus WOS CrossRef Unpaywall
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TITLE: Structural insights into the interactions of repositioning and known drugs for Alzheimer's disease with hen egg white lysozyme by MM-GBSA
AUTHORS: Halder, Amit Kumar ; Mishra, Puja; Basak, Souvik; Roy, Debjani; Das, Anurag; Karmakar, Sucheta; Mondal, Ritam; Banerjee, Shrestha; De, Prakarsha; Chatterjee, Ankit; Mallick, Susmita; Hazra, Abhijit;
PUBLISHED: 2024, SOURCE: JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS
INDEXED IN: Scopus WOS
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TITLE: Unveiling structural determinants for FXR antagonism in 1,3,4-trisubstituted-Pyrazol amide derivatives: A multi-scale in silico modelling approach
AUTHORS: Soumya Mitra; Amit Kumar Halder ; Arup Koley; Nilanjan Ghosh; Parthasarathi Panda; Subhash Mandal; Maria Natalia Cordeiro;
PUBLISHED: 2024, SOURCE: Computers in Biology and Medicine, VOLUME: 180
INDEXED IN: Scopus CrossRef
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TITLE: Designing multi-target drugs for the treatment of major depressive disorder
AUTHORS: Halder, Amit Kumar ; Mitra, Soumya; Cordeiro, Maria Natalia D. S. ;
PUBLISHED: 2023, SOURCE: EXPERT OPINION ON DRUG DISCOVERY, VOLUME: 18, ISSUE: 6
INDEXED IN: Scopus WOS CrossRef: 3
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TITLE: In Silico Modeling and Structural Analysis of Soluble Epoxide Hydrolase Inhibitors for Enhanced Therapeutic Design
AUTHORS: Sar, Shuvam; Mitra, Soumya; Panda, Parthasarathi; Mandal, Subhash C.; Ghosh, Nilanjan; Halder, Amit Kumar ; Cordeiro, Maria Natalia D. S. ;
PUBLISHED: 2023, SOURCE: MOLECULES, VOLUME: 28, ISSUE: 17
INDEXED IN: Scopus WOS CrossRef: 1
IN MY: ORCID
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TITLE: Multi-model in silico characterization of 3-benzamidobenzoic acid derivatives as partial agonists of Farnesoid X receptor in the management of NAFLD
AUTHORS: Mitra, Soumya; Halder, Amit Kumar ; Ghosh, Nilanjan; Mandal, Subhash C.; Cordeiro, M. Natalia D. S. ;
PUBLISHED: 2023, SOURCE: COMPUTERS IN BIOLOGY AND MEDICINE, VOLUME: 157
INDEXED IN: Scopus WOS CrossRef
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