AIMC Topic: Computational Biology

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Protein Crystallization Identification via Fuzzy Model on Linear Neighborhood Representation.

IEEE/ACM transactions on computational biology and bioinformatics
X-ray crystallography is the most popular approach for analyzing protein 3D structure. However, the success rate of protein crystallization is very low (2-10 percent). To reduce the cost of time and resources, lots of computation-based methods are de...

MANORAA: A machine learning platform to guide protein-ligand design by anchors and influential distances.

Structure (London, England : 1993)
The MANORAA platform uses structure-based approaches to provide information on drug design originally derived from mapping tens of thousands of amino acids on a grid. In-depth analyses of the pockets, frequently occurring atoms, influential distances...

DeepCellState: An autoencoder-based framework for predicting cell type specific transcriptional states induced by drug treatment.

PLoS computational biology
Drug treatment induces cell type specific transcriptional programs, and as the number of combinations of drugs and cell types grows, the cost for exhaustive screens measuring the transcriptional drug response becomes intractable. We developed DeepCel...

WinBinVec: Cancer-Associated Protein-Protein Interaction Extraction and Identification of 20 Various Cancer Types and Metastasis Using Different Deep Learning Models.

IEEE journal of biomedical and health informatics
Biophysical protein-protein interactions perform dominant roles in the initiation and progression of many cancer-related pathways. A protein-protein interaction might play different roles in diverse cancer types. Hence, prioritizing the PPIs in each ...

Differentiable biology: using deep learning for biophysics-based and data-driven modeling of molecular mechanisms.

Nature methods
Deep learning using neural networks relies on a class of machine-learnable models constructed using 'differentiable programs'. These programs can combine mathematical equations specific to a particular domain of natural science with general-purpose, ...

SCMAG: A Semisupervised Single-Cell Clustering Method Based on Matrix Aggregation Graph Convolutional Neural Network.

Computational and mathematical methods in medicine
Clustering analysis is one of the most important technologies for single-cell data mining. It is widely used in the division of different gene sequences, the identification of functional genes, and the detection of new cell types. Although the tradit...

Classification of Alzheimer's Disease Using Gaussian-Based Bayesian Parameter Optimization for Deep Convolutional LSTM Network.

Computational and mathematical methods in medicine
Alzheimer's disease (AD) is one of the most important causes of mortality in elderly people, and it is often challenging to use traditional manual procedures when diagnosing a disease in the early stages. The successful implementation of machine lear...

Segmentation of Overlapping Cervical Cells with Mask Region Convolutional Neural Network.

Computational and mathematical methods in medicine
The task of segmenting cytoplasm in cytology images is one of the most challenging tasks in cervix cytological analysis due to the presence of fuzzy and highly overlapping cells. Deep learning-based diagnostic technology has proven to be effective in...

Competency of Neural Networks for the Numerical Treatment of Nonlinear Host-Vector-Predator Model.

Computational and mathematical methods in medicine
The aim of this work is to introduce a stochastic solver based on the Levenberg-Marquardt backpropagation neural networks (LMBNNs) for the nonlinear host-vector-predator model. The nonlinear host-vector-predator model is dependent upon five classes, ...

Pancreatic Cancer Survival Prediction: A Survey of the State-of-the-Art.

Computational and mathematical methods in medicine
Cancer early detection increases the chances of survival. Some cancer types, like pancreatic cancer, are challenging to diagnose or detect early, and the stages have a fast progression rate. This paper presents the state-of-the-art techniques used in...