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mmff94 optimization routine  (ChemAxon LLC)

 
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    ChemAxon LLC mmff94 optimization routine
    Mmff94 Optimization Routine, supplied by ChemAxon LLC, 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/mmff94+optimization+routine/mmff94+force+field/10__1039_slash_c5ra20775d-44-6-9
    Average 90 stars, based on 1 article reviews
    mmff94 optimization routine - by Bioz Stars, 2026-09
    90/100 stars

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    other:

    Article Title: A QSPR study on the liquid crystallinity of five-ring bent-core molecules using decision trees, MARS and artificial neural networks
    Article Snippet: The structures were initially optimized using MMFF94 optimization routine (ChemAxon, Marvin21) and the nal geometries of the minimum energy conformation were obtained.

    Software:

    Article Title: A GMDH-type neural network with multi-filter feature selection for the prediction of transition temperatures of bent-core liquid crystals
    Article Snippet: .. Structure optimization and descriptor generation The molecular structures were firstly sketched in ChemDraw software, and then initially optimized using MMFF94 optimization routine (ChemAxon, Marvin27). ..



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