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  • 1-10 ل  1,363 نتائج ل ""Models, Molecular""
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Academic Journal

Importance of Inter-residue Contacts for Understanding Protein Folding and Unfolding Rates, Remote Homology, and Drug Design.

  • Authors : Harihar B; Department of Bioinformatics, School of Life Sciences, Bharathidasan University, Tiruchirappalli, Tamil Nadu, 620024, India.; Department of Biotechnology, Bhupat and Jyoti Mehta School of Biosciences, Indian Institute of Technology Madras, Chennai, Tamil Nadu, 600036, India.

Subjects: Protein Folding* ; Proteins*/Proteins*/Proteins*/chemistry ; Proteins*/Proteins*/Proteins*/metabolism

  • Source: Molecular biotechnology [Mol Biotechnol] 2025 Mar; Vol. 67 (3), pp. 862-884. Date of Electronic Publication: 2024 Mar 18.Publisher: Springer Country of Publication: Switzerland NLM ID: 9423533 Publication Model: Print-Electronic Cited Medium:

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Academic Journal

Structural and Functional Analysis of Groundnut bud necrosis virus (GBNV) Using Computational and Biochemical Approaches.

  • Authors : Jamwal R; Gut Biology Laboratory, Department of Zoology, University of Delhi, Room No. 117, New Delhi, 110007, India.; Department of Zoology, Miranda House, University of Delhi, New Delhi, 110007, India.

Subjects: Tospovirus*/Tospovirus*/Tospovirus*/genetics; Animals ; Mice

  • Source: Molecular biotechnology [Mol Biotechnol] 2025 Jan; Vol. 67 (1), pp. 246-259. Date of Electronic Publication: 2024 Jan 30.Publisher: Springer Country of Publication: Switzerland NLM ID: 9423533 Publication Model: Print-Electronic Cited Medium:

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Academic Journal

Druggable hot spots in trypanothione reductase: novel insights and opportunities for drug discovery revealed by DRUGpy.

  • Authors : Teixeira O; Laboratorio de Cristalografia de Proteínas, Faculdade de Ciências Farmacêuticas de Ribeirão Preto - USP, Address Av. do Café, s/n - Vila Monte Alegre, SP, 14040-903, Ribeirão Preto, Brazil.; Lacerda P

Subjects: Drug Discovery* ; Models, Molecular* ; Software*

  • Source: Journal of computer-aided molecular design [J Comput Aided Mol Des] 2021 Aug; Vol. 35 (8), pp. 871-882. Date of Electronic Publication: 2021 Jun 28.Publisher: Springer Country of Publication: Netherlands NLM ID: 8710425 Publication Model: Print-Electronic Cited Medium:

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Academic Journal

Characterization of PD-L1 binding sites by a combined FMO/GRID-DRY approach.

  • Authors : Paciotti R; Department of Pharmacy, Università 'G. D'Annunzio' Di Chieti-Pescara, Chieti, Italy. .; Agamennone M

Subjects: Models, Molecular*; B7-H1 Antigen/B7-H1 Antigen/B7-H1 Antigen/*chemistry ; B7-H1 Antigen/B7-H1 Antigen/B7-H1 Antigen/*metabolism

  • Source: Journal of computer-aided molecular design [J Comput Aided Mol Des] 2020 Aug; Vol. 34 (8), pp. 897-914. Date of Electronic Publication: 2020 Mar 17.Publisher: Springer Country of Publication: Netherlands NLM ID: 8710425 Publication Model: Print-Electronic Cited Medium:

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Academic Journal

How N-(pyridin-4-yl)pyridin-4-amine and its methyl and nitro derivatives are arranged in the interlayer space of zirconium sulfophenylphosphonate: a problem solved by experimental and calculation methods.

  • Authors : Kovář P; Faculty of Mathematics and Physics, Charles University, Ke Karlovu 3, 121 16, Prague 2, Czech Republic.; Škoda J

Subjects: Models, Molecular*; Amines/Amines/Amines/*chemistry ; Pyridines/Pyridines/Pyridines/*chemistry

  • Source: Journal of computer-aided molecular design [J Comput Aided Mol Des] 2020 Jun; Vol. 34 (6), pp. 683-695. Date of Electronic Publication: 2020 Feb 12.Publisher: Springer Country of Publication: Netherlands NLM ID: 8710425 Publication Model: Print-Electronic Cited Medium:

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Academic Journal

Atomistic insight into sequence-directed DNA bending and minicircle formation propensity in the absence and presence of phased A-tracts.

  • Authors : Mills A; Area of Pharmacology, Department of Biomedical Sciences and 'Unidad Asociada IQM-CSIC', School of Medicine and Health Sciences, University of Alcalá, 28805, Alcalá de Henares, Madrid, Spain.; Gago F

Subjects: Models, Molecular* ; Nucleic Acid Conformation*; DNA/DNA/DNA/*ultrastructure

  • Source: Journal of computer-aided molecular design [J Comput Aided Mol Des] 2020 Mar; Vol. 34 (3), pp. 253-265. Date of Electronic Publication: 2020 Jan 16.Publisher: Springer Country of Publication: Netherlands NLM ID: 8710425 Publication Model: Print-Electronic Cited Medium:

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Academic Journal

Influence of feature rankers in the construction of molecular activity prediction models.

Subjects: Models, Molecular* ; Software*; Algorithms

  • Source: Journal of computer-aided molecular design [J Comput Aided Mol Des] 2020 Mar; Vol. 34 (3), pp. 305-325. Date of Electronic Publication: 2019 Dec 31.Publisher: Springer Country of Publication: Netherlands NLM ID: 8710425 Publication Model: Print-Electronic Cited Medium:

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Academic Journal

The functional impact of the C/N-terminal extensions of the mouse retinal IMPDH1 isoforms: a kinetic evaluation.

  • Authors : Andashti B; Institute of Biochemistry and Biophysics, University of Tehran, P. O. Box 13145-1384, Tehran, Iran.; Yazdanparast R

Subjects: Models, Molecular*; IMP Dehydrogenase/IMP Dehydrogenase/IMP Dehydrogenase/*chemistry ; Retina/Retina/Retina/*enzymology

  • Source: Molecular and cellular biochemistry [Mol Cell Biochem] 2020 Feb; Vol. 465 (1-2), pp. 155-164. Date of Electronic Publication: 2019 Dec 14.Publisher: Springer Country of Publication: Netherlands NLM ID: 0364456 Publication Model: Print-Electronic Cited Medium:

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Academic Journal

In Silico and Experimental Studies on the Effect of α3 and α5 Deletion on the Biochemical Properties of Bacillus thermocatenulatus Lipase.

  • Authors : Karkhane AA; Department of Systems Biotechnology, Institute of Industrial and Environmental Biotechnology, National Institute of Genetic Engineering and Biotechnology (NIGEB), Tehran, Iran. .; Department of Industrial and Environmental Biotechnology, National Institute of Genetic Engineering and Biotechnology (NIGEB), P.O. Box 14965/161, Tehran, Iran. .

Subjects: Lipase*/Lipase*/Lipase*/genetics ; Lipase*/Lipase*/Lipase*/metabolism ; Lipase*/Lipase*/Lipase*/chemistry

  • Source: Molecular biotechnology [Mol Biotechnol] 2024 Aug; Vol. 66 (8), pp. 1894-1906. Date of Electronic Publication: 2023 Jul 22.Publisher: Springer Country of Publication: Switzerland NLM ID: 9423533 Publication Model: Print-Electronic Cited Medium:

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Academic Journal

Optimisation of human V H domain antibodies specific to Mycobacterium tuberculosis heat shock protein (HSP16.3).

  • Authors : Soong JX; Institute for Research in Molecular Medicine (INFORMM), Universiti Sains Malaysia, Minden, 11800, Penang, Malaysia.; Chan SK

Subjects: Computer Simulation* ; Models, Molecular*; Antibodies/Antibodies/Antibodies/*chemistry

  • Source: Journal of computer-aided molecular design [J Comput Aided Mol Des] 2019 Mar; Vol. 33 (3), pp. 375-385. Date of Electronic Publication: 2019 Jan 28.Publisher: Springer Country of Publication: Netherlands NLM ID: 8710425 Publication Model: Print-Electronic Cited Medium:

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  • 1-10 ل  1,363 نتائج ل ""Models, Molecular""