AI Medical Compendium Journal:
Computational biology and chemistry

Showing 61 to 70 of 191 articles

Towards key genes identification for breast cancer survival risk with neural network models.

Computational biology and chemistry
Breast cancer, one common malignant tumor all over the world, has a considerably high rate of recurrence, which endangers the health and life of patients. While more and more data have been available, how to leverage the gene expression data to predi...

A novel radial basis neural network for the Zika virus spreading model.

Computational biology and chemistry
The motive of current investigations is to design a novel radial basis neural network stochastic structure to present the numerical representations of the Zika virus spreading model (ZVSM). The mathematical ZVSM is categorized into humans and vectors...

Quantum-level machine learning calculations of Levodopa.

Computational biology and chemistry
Many drug molecules contain functional groups, resulting in a torsional barrier corresponding to rotation around the bond linking the fragments. In medicinal chemistry and pharmaceutical sciences, inclusive of drug design studies, the exact calculati...

Computational approaches for lead compound discovery in dipeptidyl peptidase-4 inhibition using machine learning and molecular dynamics techniques.

Computational biology and chemistry
The prediction of possible lead compounds from already-known drugs that may present DPP-4 inhibition activity imply a advantage in the drug development in terms of time and cost to find alternative medicines for the treatment of Type 2 Diabetes Melli...

ACDMBI: A deep learning model based on community division and multi-source biological information fusion predicts essential proteins.

Computational biology and chemistry
Accurately identifying essential proteins is vital for drug research and disease diagnosis. Traditional centrality methods and machine learning approaches often face challenges in accurately discerning essential proteins, primarily relying on informa...

UmamiPreDL: Deep learning model for umami taste prediction of peptides using BERT and CNN.

Computational biology and chemistry
Taste is crucial in driving food choice and preference. Umami is one of the basic tastes defined by characteristic deliciousness and mouthfulness that it imparts to foods. Identification of ingredients to enhance umami taste is of significant value t...

Integrating classic AI and agriculture: A novel model for predicting insecticide-likeness to enhance efficiency in insecticide development.

Computational biology and chemistry
The integration of artificial intelligence (AI) into smart agriculture boosts production and management efficiency, facilitating sustainable agricultural development. In intensive agricultural management, adopting eco-friendly and effective pesticide...

Knowledge enhanced attention aggregation network for medicine recommendation.

Computational biology and chemistry
The combination of deep learning and the medical field has recently achieved great success, particularly in recommending medicine for patients. However, patients' clinical records often contain repeated medical information that can significantly impa...

ACP-ESM2: The prediction of anticancer peptides based on pre-trained classifier.

Computational biology and chemistry
Anticancer peptides (ACPs) are a type of protein molecule that has anti-cancer activity and can inhibit cancer cell growth and survival. Traditional classification approaches for ACPs are expensive and time-consuming. This paper proposes a pre-traine...

Differentiating stable and unstable protein using convolution neural network and molecular dynamics simulations.

Computational biology and chemistry
Protein stability is a critical aspect of molecular biology and biochemistry, hinges on an intricate balance of thermodynamic and structural factors. Determining protein stability is crucial for understanding and manipulating biological machineries, ...