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Everything about Autochem
AutoChem is NASA release software that constitutes an automatic computer code generator and documenter for chemically reactive systems written by David Lary between 1993 and the present. It was designed primarily for modeling atmospheric chemistry, and in particular, for chemical data assimilation. Wikipedia →
🧭 Start here: a 6-step reading path
- Read the overview: AutochemA 5-minute orientation
- Read the landmark paper: Automatic On-Demand Data Feed Service for AutoChem Based on Reusable Geo-Processing WorkflowCited 12 times
- Go sideways: Kinetic PreProcessorA closely related topic
- Go sideways: Ordinary differential equationA closely related topic
📖 Definitions
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🗂️ The subject at a glance
No outline available.
🏆 Landmark papers (most cited)
Automatic On-Demand Data Feed Service for AutoChem Based on Reusable Geo-Processing Workflow
AutoChem: Automated Solution-Phase Parallel Synthesis and Purification via HPLC
CrysAlisPro 38 : data quality, fast experimentation, AutoChem 2.1 and StructureExplorer
AutoChem: A comprehensive tool for reaction prediction, network generation, and free energy calculation in chemistry
Dynamical refinement against 3D-ED data in Olex2–AutoChem using the N-Beam approach
📚 Books worth reading
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🔗 Related topics
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- Atmospheric chemistry Atmospheric chemistry is a branch of atmospheric science that studies the chemistry of the Earth's atmosphere and that of other planets. This multidisciplinary…
- Differential-algebraic system of equations In mathematics, a differential-algebraic system of equations (DAE) is a system of equations that either contains differential equations and algebraic equations…
- Gauss–Newton algorithm In numerical methods, the Gauss–Newton algorithm is an iterative algorithm to solve non-linear least squares problems. It is an extension of Newton's method…