Result Number | Material Type | Add to My Shelf Action | Record Details and Options |
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Material Type: Artigo
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High‐throughput computational investigation of protein electrostatics and cavity for SAM‐dependent methyltransferasesJurich, Christopher ; Yang, Zhongyue J.Protein science, 2023-07, Vol.32 (7), p.e4690-n/a [Periódico revisado por pares]Hoboken, USA: John Wiley & Sons, IncTexto completo disponível |
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2 |
Material Type: Artigo
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Stabilizing proteins, simplified: A Rosetta‐based webtool for predicting favorable mutationsThieker, David F. ; Maguire, Jack B. ; Kudlacek, Stephan T. ; Leaver‐Fay, Andrew ; Lyskov, Sergey ; Kuhlman, BrianProtein science, 2022-10, Vol.31 (10), p.e4428-n/a [Periódico revisado por pares]Hoboken, USA: John Wiley & Sons, IncTexto completo disponível |
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3 |
Material Type: Artigo
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Perturbing the energy landscape for improved packing during computational protein designMaguire, Jack B. ; Haddox, Hugh K. ; Strickland, Devin ; Halabiya, Samer F. ; Coventry, Brian ; Griffin, Jermel R. ; Pulavarti, Surya V. S. R. K ; Cummins, Matthew ; Thieker, David F ; Klavins, Eric ; Szyperski, Thomas ; DiMaio, Frank ; Baker, David ; Kuhlman, BrianProteins, structure, function, and bioinformatics, 2021-04, Vol.89 (4), p.436-449 [Periódico revisado por pares]Hoboken, USA: John Wiley & Sons, IncTexto completo disponível |
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4 |
Material Type: Artigo
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An Overview of Molecular Modeling for Drug Discovery with Specific Illustrative Examples of ApplicationsAminpour, Maral ; Montemagno, Carlo ; Tuszynski, Jack AMolecules (Basel, Switzerland), 2019-04, Vol.24 (9), p.1693 [Periódico revisado por pares]Switzerland: MDPI AGTexto completo disponível |
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Material Type: Artigo
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Identification of Potential COX-2 Inhibitors for the Treatment of Inflammatory Diseases Using Molecular Modeling ApproachesAraújo, Pedro H F ; Ramos, Ryan S ; da Cruz, Jorddy N ; Silva, Sebastião G ; Ferreira, Elenilze F B ; de Lima, Lúcio R ; Macêdo, Williams J C ; Espejo-Román, José M ; Campos, Joaquín M ; Santos, Cleydson B RMolecules (Basel, Switzerland), 2020-09, Vol.25 (18), p.4183 [Periódico revisado por pares]Switzerland: MDPI AGTexto completo disponível |
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Material Type: Artigo
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Novel ACTG2 variants disclose allelic heterogeneity and bi‐allelic inheritance in pediatric chronic intestinal pseudo‐obstructionMatera, Ivana ; Bordo, Domenico ; Di Duca, Marco ; Lerone, Margherita ; Santamaria, Giuseppe ; Pongiglione, Marta ; Lezo, Antonella ; Diamanti, Antonella ; Spagnuolo, Maria Immacolata ; Pini Prato, Alessio ; Alberti, Daniele ; Mattioli, Girolamo ; Gandullia, Paolo ; Ceccherini, IsabellaClinical genetics, 2021-03, Vol.99 (3), p.430-436 [Periódico revisado por pares]Oxford, UK: Blackwell Publishing LtdTexto completo disponível |
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Material Type: Artigo
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Multiscale molecular simulations to investigate adenylyl cyclase‐based signaling in the brainKeulen, Siri C. ; Martin, Juliette ; Colizzi, Francesco ; Frezza, Elisa ; Trpevski, Daniel ; Diaz, Nuria Cirauqui ; Vidossich, Pietro ; Rothlisberger, Ursula ; Hellgren Kotaleski, Jeanette ; Wade, Rebecca C. ; Carloni, PaoloWiley interdisciplinary reviews. Computational molecular science, 2023-01, Vol.13 (1), p.e1623-n/a [Periódico revisado por pares]Hoboken, USA: Wiley Periodicals, IncTexto completo disponível |
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8 |
Material Type: Artigo
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De novo design of stable proteins that efficaciously inhibit oncogenic G proteinsCummins, Matthew C. ; Tripathy, Ashutosh ; Sondek, John ; Kuhlman, BrianProtein science, 2023-08, Vol.32 (8), p.e4713-n/a [Periódico revisado por pares]Hoboken, USA: John Wiley & Sons, IncTexto completo disponível |
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9 |
Material Type: Artigo
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Chiral Capillary Electrokinetic Chromatography: Principle and Applications, Detection and Identification, Design of Experiment, and Exploration of Chiral Recognition Using Molecular ModelingEl Deeb, Sami ; Silva, Camilla Fonseca ; Junior, Clebio Soares Nascimento ; Hanafi, Rasha Sayed ; Borges, Keyller BastosMolecules (Basel, Switzerland), 2021-05, Vol.26 (10), p.2841 [Periódico revisado por pares]Switzerland: MDPI AGTexto completo disponível |
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10 |
Material Type: Artigo
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Novel Sulfonamide-Based Carbamates as Selective Inhibitors of BChEMagar, Pratibha ; Parravicini, Oscar ; Štěpánková, Šárka ; Svrčková, Katarina ; Garro, Adriana D. ; Jendrzejewska, Izabela ; Pauk, Karel ; Hošek, Jan ; Jampílek, Josef ; Enriz, Ricardo D. ; Imramovský, AlešInternational journal of molecular sciences, 2021-09, Vol.22 (17), p.9447 [Periódico revisado por pares]Basel: MDPI AGTexto completo disponível |