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  • 1-10 ل  11,547 نتائج ل ""Models, Molecular""
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Academic Journal

Variability in the Spatial Structure of the Central Loop in Cobra Cytotoxins Revealed by X-ray Analysis and Molecular Modeling.

  • Authors : Dubovskii PV; Shemyakin-Ovchinnikov Institute of Bioorganic Chemistry, Russian Academy of Sciences, 16/10 Miklukho-Maklaya str., 117997 Moscow, Russia.; Dubova KM

Subjects: Models, Molecular* ; Molecular Structure* ; Protein Conformation*

  • Source: Toxins [Toxins (Basel)] 2022 Feb 18; Vol. 14 (2). Date of Electronic Publication: 2022 Feb 18.Publisher: MDPI Country of Publication: Switzerland NLM ID: 101530765 Publication Model: Electronic Cited Medium: Internet ISSN: 2072-6651

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Academic Journal

Utilizing graph machine learning within drug discovery and development.

Subjects: Computer Graphics* ; Machine Learning* ; Models, Molecular*

  • Source: Briefings in bioinformatics [Brief Bioinform] 2021 Nov 05; Vol. 22 (6).Publisher: Oxford University Press Country of Publication: England NLM ID: 100912837 Publication Model: Print Cited Medium: Internet ISSN:

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Academic Journal

Self-Assembly of Antiferromagnetically-Coupled Copper(II) Supramolecular Architectures with Diverse Structural Complexities.

  • Authors : Tandon SS; Department of Chemistry and Biochemistry, Kent State University-Salem Campus, Salem, OH 44460, USA.; Department of Chemistry and Biochemistry, Kent State University, Kent, OH 44242, USA.

Subjects: Models, Molecular* ; Molecular Structure*; Coordination Complexes/Coordination Complexes/Coordination Complexes/*chemistry

  • Source: Molecules (Basel, Switzerland) [Molecules] 2020 Nov 26; Vol. 25 (23). Date of Electronic Publication: 2020 Nov 26.Publisher: MDPI Country of Publication: Switzerland NLM ID: 100964009 Publication Model: Electronic Cited Medium: Internet ISSN: 1420-3049

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Academic Journal

Bonding Analysis of Compounds with Unusual Coordination of Carbon: Proposed Symmetric Systems with Six-Coordinate Carbon.

  • Authors : Trindle C; Chemistry Department, University of Virginia, Charlottesville, VA 22904, USA.; Altun Z

Subjects: Models, Chemical* ; Models, Molecular* ; Molecular Structure*

  • Source: Molecules (Basel, Switzerland) [Molecules] 2020 Aug 28; Vol. 25 (17). Date of Electronic Publication: 2020 Aug 28.Publisher: MDPI Country of Publication: Switzerland NLM ID: 100964009 Publication Model: Electronic Cited Medium: Internet ISSN: 1420-3049

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Academic Journal

VAE-Sim: A Novel Molecular Similarity Measure Based on a Variational Autoencoder.

  • Authors : Samanta S; Department of Biochemistry and Systems Biology, Institute of Systems, Molecular and Integrative Biology, University of Liverpool, Crown St, Liverpool L69 7ZB, UK.; O'Hagan S

Subjects: Models, Molecular* ; Molecular Structure*; Cheminformatics/Cheminformatics/Cheminformatics/*methods

  • Source: Molecules (Basel, Switzerland) [Molecules] 2020 Jul 29; Vol. 25 (15). Date of Electronic Publication: 2020 Jul 29.Publisher: MDPI Country of Publication: Switzerland NLM ID: 100964009 Publication Model: Electronic Cited Medium: Internet ISSN: 1420-3049

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Academic Journal

Structural Elucidation of Malonylcommunol and 6β-Hydroxy- trans -communic Acid, Two Undescribed Diterpenes from Salvia cinnabarina . First Examples of Labdane Diterpenoids from a Mexican Salvia Species.

  • Authors : Bustos-Brito C; Instituto de Química, Universidad Nacional Autónoma de México, Circuito Exterior, Ciudad Universitaria, Mexico City 04510, Mexico.; Nieto-Camacho A

Subjects: Models, Molecular* ; Molecular Structure*; Diterpenes/Diterpenes/Diterpenes/*chemistry

  • Source: Molecules (Basel, Switzerland) [Molecules] 2020 Apr 15; Vol. 25 (8). Date of Electronic Publication: 2020 Apr 15.Publisher: MDPI Country of Publication: Switzerland NLM ID: 100964009 Publication Model: Electronic Cited Medium: Internet ISSN: 1420-3049

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Academic Journal

Structure and Function of Filamin C in the Muscle Z-Disc.

  • Authors : Mao Z; School of Pharmaceutical Science and Technology, Tianjin University, Tianjin 300072, China.; Nakamura F

Subjects: Models, Molecular* ; Molecular Structure*; Filamins/Filamins/Filamins/*chemistry

  • Source: International journal of molecular sciences [Int J Mol Sci] 2020 Apr 13; Vol. 21 (8). Date of Electronic Publication: 2020 Apr 13.Publisher: MDPI Country of Publication: Switzerland NLM ID: 101092791 Publication Model: Electronic Cited Medium: Internet ISSN: 1422-0067

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Academic Journal

Improved Predictive Tools for Structural Properties of Metal-Organic Frameworks.

  • Authors : Choudhuri I; Department of Chemistry, Chemical Theory Center, and Minnesota Supercomputing Institute, University of Minnesota, Minneapolis, MN 55455-0431, USA.; Truhlar DG

Subjects: Metal-Organic Frameworks* ; Models, Molecular* ; Molecular Structure*

  • Source: Molecules (Basel, Switzerland) [Molecules] 2020 Mar 28; Vol. 25 (7). Date of Electronic Publication: 2020 Mar 28.Publisher: MDPI Country of Publication: Switzerland NLM ID: 100964009 Publication Model: Electronic Cited Medium: Internet ISSN: 1420-3049

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Academic Journal

The Monetite Structure Probed by Advanced Solid-State NMR Experimentation at Fast Magic-Angle Spinning.

  • Authors : Yu Y; Department of Materials and Environmental Chemistry, Stockholm University, SE-106 91 Stockholm, Sweden.; Stevensson B

Subjects: Models, Molecular* ; Molecular Structure*; Calcium Phosphates/Calcium Phosphates/Calcium Phosphates/*chemistry

  • Source: International journal of molecular sciences [Int J Mol Sci] 2019 Dec 17; Vol. 20 (24). Date of Electronic Publication: 2019 Dec 17.Publisher: MDPI Country of Publication: Switzerland NLM ID: 101092791 Publication Model: Electronic Cited Medium: Internet ISSN: 1422-0067

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Academic Journal

Structural Consequences of Copper Binding to the Prion Protein.

  • Authors : Salzano G; Department of Neuroscience, Scuola Internazionale Superiore di Studi Avanzati (SISSA), 34136 Trieste, Italy.; Giachin G

Subjects: Models, Molecular* ; Molecular Structure*; Copper/Copper/Copper/*chemistry

  • Source: Cells [Cells] 2019 Jul 25; Vol. 8 (8). Date of Electronic Publication: 2019 Jul 25.Publisher: MDPI Country of Publication: Switzerland NLM ID: 101600052 Publication Model: Electronic Cited Medium: Internet ISSN: 2073-4409

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  • 1-10 ل  11,547 نتائج ل ""Models, Molecular""