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lamarck genetic algorithm of autodock software  (AUTODOCK GmbH)

 
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    AUTODOCK GmbH lamarck genetic algorithm of autodock software
    Lamarck Genetic Algorithm Of Autodock Software, supplied by AUTODOCK GmbH, used in various techniques. Bioz Stars score: 90/100, based on 1 PubMed citations. ZERO BIAS - scores, article reviews, protocol conditions and more
    https://www.bioz.com/product/genetic+algorithm+software/lamarckian+genetic+algorithm+autodock+3+0/pm40250653-95-0-4
    Average 90 stars, based on 1 article reviews
    lamarck genetic algorithm of autodock software - by Bioz Stars, 2026-10
    90/100 stars

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    other:

    Article Title: Comprehensive assessment of estrogenic activities of parabens by in silico approach and in vitro assays.
    Article Snippet: • Side-chain moieties of paraben are predominant to their binding to ER LBD.. • Among tested parabens, BzP was the most

    Article Title: Para -Aminobenzohydrazide Derivatives as Fatty Acid Amide Hydrolase Inhibitors: Design, Synthesis and Biological Evaluation
    Article Snippet: Molecular Modeling Studies Spatial interaction in FAAH active site was simulated using AutoDock 4.0 software (Lamarckian genetic algorithm) to predict the interaction of the synthesized compounds.

    Article Title: Carrageenan-xanthan gum composite gel achieves the elimination of bitterness and easy swallowability of Coptis chinensis based on electrostatic induction and interpenetrating network interaction.
    Article Snippet: Natural polysaccharides possess the potential function of masking bitterness due to their three-dimensional network structures.. However, they also have relatively high mechanical strength, which is not conducive to swallowing.. Taking Coptis chinensis as an example, this study developed a composite gel composed of 0.17 % iotacarrageenan, 0.13 % lambda-carrageenan and 0.17 % xanthan gum.

    Article Title: The Effect of Metal Ions (Fe, Co, Ni, and Cu) on the Molecular-Structural, Protein Binding, and Cytotoxic Properties of Metal Pyridoxal-Thiosemicarbazone Complexes.
    Article Snippet: The Autodock 4.2 software [72] with the Lamarckian Genetic Algorithm (LGA) was employed to determine the binding affinity of the compounds towards the mentioned biomolecules [73–75].

    Article Title: Engineered the Active Site of ω-Transaminase for Enhanced Asymmetric Synthesis Towards (S)-1-[4-(Trifluoromethyl)phenyl]ethylamine.
    Article Snippet: ω-Transaminase (ω-TA) is a promising biocatalyst for the synthesis of chiral amines.. In this study, a ω-TA derived from Vitreoscilla stercoraria DSM 513 (VsTA) was heterologous expressed in recombinant E. coli cells and applied to reduce 4′-(trifluoromethyl)acetophenone (TAP) to (S)-1-[4-(trifluoromethyl)phenyl]ethylamine ((S)-TPE), a pharmaceutical intermediate of chiral amine.. Aimed to a more efficient synthesis of (S)-TPE, VsTA was further engineered via a semi-rational strategy.

    Software:

    Article Title: Molecular Docking and Pharmacological In Silico Evaluation of Camptothecin and Related Ligands as Promising HER2-Targeted Therapies for Breast Cancer.
    Article Snippet: .. This is due to current limitations in considering the entire flexible system, such as the genetic algorithm in the Autodock Tools software, which allows a maximum of five flexible amino acids. ..

    Article Title: Ginsenoside Rh4 inhibits breast cancer growth through targeting histone deacetylase 2 to regulate immune microenvironment and apoptosis.
    Article Snippet: High expression of histone deacetylase 2 (HDAC2) is recognized as a marker of invasive breast cancer (BC).. HDAC2 is not only responsible for enhancing tumor cell growth, development, and anti-apoptosis, but also plays a significant role in regulating PD-L1 on the surface of tumor cells.. Continuous expression of PD-L1 allows tumor cells to escape immune surveillance.

    Article Title: Lable-free aptamer portable colorimetric smartphone for gliadin detection in food
    Article Snippet: .. Subsequently, the Lamarckian genetic algorithm of the AutoDock 4.2 software was used for multiple docking calculations, and the combination of free energy was used as the basis for evaluating the final docking form. ..



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