CALCULATION METHODS IN COMPUTING

Open Science Framework 2026 Open access

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Authors: Rahadian Zainul, intan elwis khairina muzia, Iffat Syafiqoh Afif, Yuni Poliza, Zsa Zsa Fitria Alizar, Afdila Nada
DOI: 10.17605/osf.io/dygcu
Cited by: 0

Abstract

Molecular Mechanics (MM) is a method in computational chemistry that uses the laws ofNewtonian classical mechanicsto model and calculate the properties of molecular systems (Susilo, A., 2023). Unlike quantum mechanics-based methods that calculate electron wave functions, MM does not explicitly consider electrons. Molecules are viewed as a collection of atoms (considered as spheres) and bonds (considered as springs).

Fields of Study & Subjects

Advanced Physical and Chemical Molecular Interactions Railway Systems and Materials Science Inorganic and Organometallic Chemistry

Publication details

Journal / source
Open Science Framework
Publication date
1 January 2026