Background: In the last decade, cancer has been a leading cause of death worldwide.
Despite the impressive progress in cancer therapy, firsthand treatments are not selective to …

An increasing number of crystal structures available on one side, and the boost of
computational power available for computer-aided drug design tasks on the other, have …

Proteins are the important biological macromolecules that are targeted by most of the
existing drugs. SBDD play a critical role in design of drug-like, novel, potent, and safe …

The new and novel drug molecules are of prime importance against the deadly
Mycobacterium tuberculosis owing to its high resistance. The discovery of new drug …

A doença de Alzheimer (DA) é uma doença neurodegenerativa que ainda não possui forma
eficaz de tratamento e gera graves impactos econômicos e sociais. Dentre as suas …

Antimicrobial resistance (AMR) poses challenges to healthcare systems around the world as
drug-resistant pathogens emerge. The rapid spread of AMR could render current treatments …

The emergence of cloud computing, greatly changed the way of data processing, it makes
the data center from an independent individual to a large-scale, automated direction. Virtual …

Can state-of-the-art computer vision methods be applied for protein structure determination
tasks? This thesis answers the above question by defining the problem of locating and …

Drug discovery is the process in which healthcare is approached through identification of
potential new therapeutic agents. CADD provides solutions at every stage of drug discovery …

The chapter describes the understanding and the application of the concept of the various AI
algorithms that also include reinforcement learning algorithms, which is a great contribution …