Computational chemistry is a branch of chemistry that uses computer simulation to assist in solving chemical problems. The term computational chemistry is usually used when a mathematical method is sufficiently well developed that it can be automated for implementation on a computer.
In theoretical chemistry, chemists, physicists, and mathematicians develop algorithms and computer programs to predict atomic and molecular properties and reaction paths for chemical reactions. Computational chemists, in contrast, may simply apply existing computer programs and methodologies to specific chemical questions.
It becomes very essential to handle and apply the existing computational softwares and packages to be efficient in the field of computational chemistry. Here I'll help you to achieve the goal.
:(: WELCOME TO COMPCHEM STUDIO. WELCOME TO THE COMPUTATIONAL WORLD :):
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I'm Aritra Roy, a Doctoral Researcher at London South Bank University, UK.
Website: aritraroy.live
16 June 2021