MassKinetics Version

Demo

Edu

Sci

Reaction Scheme Features

Single Reaction (M->A)

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Paralell Reaction (M->A, M->B)

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Consecutive Reaction (M->A->B)

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Complex reaction schemes

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General Reaction Scheme (user defined reaction scheme)

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Equipartitioning

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Statistical Energy Partitioning

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Advanced reaction features (taking into account Energy Balance, Non-statistical Energy, etc.)

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Reaction Rate Calculation Feature

RRKM

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Transition State: typical models (e.g. simple loose)

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Transition State: defined by Arrhenius factor

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Transition State: user defined

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Standard frequency models (e.g.: standatd peptide model)

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Initial Energy Distributions

Thermal Initial Energy Distribution

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Single Initial Energy

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Special Energy Distributions (e.g. for FAB, EI, ESI, MALDI)

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User-defined Initial Energy Distribution

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Radiative Energy Transfer Models

Dunbar’s standard hydrocarbon model (scaled)

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Standard peptide or organic model with IR Activity

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User-defined IR Activities

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Collisional Energy Transfer Features

Long-lived collision complex model

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Partially elastic collisions

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Partially elastic collisions with cooling

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Energy Transfer Functions: exponential

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Energy Transfer Functions: special functions (e.g. half-gaussian, polinomial)

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Multiple collision gas

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Description of collisions (e.g. energy transfer efficiency) can be set as a function of collision energy (E_com)

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Kinetic Energy

Single-valued (variable) kinetic energy

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Kinetic Energy Distribution

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MS Experiments

Electrostatic Acceleration

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Resonant Excitation Pulse

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SORI Excitation

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Field Free Flight

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Collision Cascade/Collision Cell

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Surface Induced Decomposition (SID)

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Ion Selection

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Ion Selection Followed by Detection

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Parameter Scanning Features

1D Parameter Scanning

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2D Parameter Scanning

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