All operations are GUI-based! Docking simulations can be easily performed.
"MF myPresto" is the graphical user interface (GUI) software for the molecular simulation program myPresto, which is developed at the National Institute of Advanced Industrial Science and Technology. By using this software, molecular dynamics (MD) calculations, docking simulations, and in-silico screenings with myPresto can be easily performed. All operations are GUI-based, so there is no need to memorize command operations. It can be widely used by everyone from beginners to professional users. 【Features】 ■ A suite of molecular simulation calculation programs created to support drug development ■ Converts the two-dimensional structure of compounds into three-dimensional structures ■ Allows for modeling of proteins, drug docking, and in-silico screenings to be conducted with high precision and efficiency in a shorter time compared to conventional methods *For more details, please refer to the PDF document or feel free to contact us.
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basic information
【Features】 ■ Molecular editing function ■ Energy minimization calculations / MD calculations ■ Trajectory analysis ■ Exploration of ligand binding pockets ■ Docking simulations ■ In-silico screening, etc... *For more details, please refer to the PDF document or feel free to contact us.
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P3
Applications/Examples of results
【Implementation Achievements】 ■Educational Institutions ・Hokkaido University ・Gunma University ・Chiba University ・Yokohama City University, among others ■Government Agencies and Public Research Institutions ・National Institute of Infectious Diseases ・National Institute of Advanced Industrial Science and Technology ・Foundation for Advanced Medical Research ・Tokyo Metropolitan Institute of Medical Science ■Private Companies ・Kyorin Pharmaceutical Co., Ltd. ・Toray Industries, Inc. ・Nissan Chemical Corporation ・Bio Modeling Research, Inc. *For more details, please refer to the PDF document or feel free to contact us.
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