Developing a Modified Version of Generative Adversarial Network to Predict the Potential Anti-Viral Drug of COVID-1

The advancements of computer science and its related fields are making our tasks easier in almost every scientific and non-scientific field. The use of machine learning in the field of drug discovery and development is accelerating so fast and helping us to discover anti-viral drugs for devastating viruses like coronavirus. The author will discuss using a deep reinforcement learning model 'ORGAN' which is a modified version of Generative Adversarial Network for predicting the potential anti-viral of coronavirus. The author used the deep reinforcement learning model (ORGAN) to generate potential candidates’ drugs, with a λ of 0.2 and epochs of 240 and a sample set of 6400, 10 good sample SMILES were generated and the Solubility or LogP of these samples is 0.7098. Then using the coronavirus as a target, all the good samples of SMILES were bounded and the drug with the highest binding affinity (Most negative value) is C18H15ClN4O2 also known as Olutasidenib which can be the potential anti-viral drug of coronavirus.

 

Author(s): Md.Sadek Hossain Asif

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