On the road to explainable AI in drug-drug interactions prediction: A systematic review

por Vo, Thanh Hoa, Nguyen, Ngan Thi Kim, Kha, Quang Hien, Le, Nguyen Quoc Khanh
Publicado 2022

DeepSCM: An efficient convolutional neural network surrogate model for the screening of therapeutic antibody viscosity

por Lai, Pin-Kuang
Publicado 2022

Using molecular dynamics simulations to interrogate T cell receptor non-equilibrium kinetics

por Rollins, Zachary A., Faller, Roland, George, Steven C.
Publicado 2022

Repurposing of thermally stable nucleic-acid aptamers for targeting tetrodotoxin (TTX)

por Li, Yuanyuan, Song, Menghua, Gao, Ruihua, Lu, Feng, Liu, Jianping, Huang, Qiang
Publicado 2022

scEFSC: Accurate single-cell RNA-seq data analysis via ensemble consensus clustering based on multiple feature selections

por Bian, Chuang, Wang, Xubin, Su, Yanchi, Wang, Yunhe, Wong, Ka-chun, Li, Xiangtao
Publicado 2022

Potential drug discovery for COVID-19 treatment targeting Cathepsin L using a deep learning-based strategy

por Yang, Wei-Li, Li, Qi, Sun, Jing, Huat Tan, Sia, Tang, Yan-Hong, Zhao, Miao-Miao, Li, Yu-Yang, Cao, Xi, Zhao, Jin-Cun, Yang, Jin-Kui
Publicado 2022

Structural bioinformatics enhances the interpretation of somatic mutations in KDM6A found in human cancers

por Chi, Young-In, Stodola, Timothy J., De Assuncao, Thiago M., Leverence, Elise N., Smith, Brian C., Volkman, Brian F., Mathison, Angela J., Lomberk, Gwen, Zimmermann, Michael T., Urrutia, Raul
Publicado 2022

Delineating the conformational landscape and intrinsic properties of the angiotensin II type 2 receptor using a computational study

por Cong, Xiaoliang, Zhang, Xiaogang, Liang, Xin, He, Xinheng, Tang, Yehua, Zheng, Xing, Lu, Shaoyong, Zhang, Jiayou, Chen, Ting
Publicado 2022

Evolving and assembling to pierce through: Evolutionary and structural aspects of antimicrobial peptides

por Chakraborty, Sukriyo, Chatterjee, Ritika, Chakravortty, Dipshikha
Publicado 2022

Whole exome sequencing reveals the genetic heterogeneity and evolutionary history of primary gliomas and matched recurrences

por Xu, Peng-Fei, Li, Cong, Xi, Shao-Yan, Chen, Fu-Rong, Wang, Jing, Zhang, Zhi-Qiang, Liu, Yan, Li, Xin, Chen, Zhong-Ping
Publicado 2022

Evaluation of stromal cell infiltration in the tumor microenvironment enable prediction of treatment sensitivity and prognosis in colon cancer

por Zhou, Rui, Wen, Zhaowei, Liao, Yifu, Wu, Jingjing, Xi, Shaoyan, Zeng, Dongqiang, Sun, Huiying, Wu, Jianhua, Shi, Min, Bin, Jianping, Liao, Yulin, Liao, Wangjun
Publicado 2022

Computational epitope binning reveals functional equivalence of sequence-divergent paratopes

por Mahita, Jarjapu, Kim, Dong-Gun, Son, Sumin, Choi, Yoonjoo, Kim, Hak-Sung, Bailey-Kellogg, Chris
Publicado 2022

Complementarity of the residue-level protein function and structure predictions in human proteins

por Biró, Bálint, Zhao, Bi, Kurgan, Lukasz
Publicado 2022

Optimizing the Illumina COVIDSeq laboratorial and bioinformatics pipeline on thousands of samples for SARS-CoV-2 Variants of Concern tracking

por Donzelli, Sara, Ciuffreda, Ludovica, Pontone, Martina, Betti, Martina, Massacci, Alice, Mottini, Carla, De Nicola, Francesca, Orlandi, Giulia, Goeman, Frauke, Giuliani, Eugenia, Sperandio, Eleonora, Piaggio, Giulia, Morrone, Aldo, Ciliberto, Gennaro, Fanciulli, Maurizio, Blandino, Giovanni, Pimpinelli, Fulvia, Pallocca, Matteo
Publicado 2022

dQTG.seq: A comprehensive R tool for detecting all types of QTLs using extreme phenotype individuals in bi-parental segregation populations

por Li, Pei, Wei, Liu-Qiong, Pan, Yi-Fan, Zhang, Yuan-Ming
Publicado 2022

Proteome-wide prediction and analysis of the Cryptosporidium parvum protein–protein interaction network through integrative methods

por Ren, Panyu, Yang, Xiaodi, Wang, Tianpeng, Hou, Yunpeng, Zhang, Ziding
Publicado 2022

OncoboxPD: human 51 672 molecular pathways database with tools for activity calculating and visualization

por Zolotovskaia, Marianna A., Tkachev, Victor S., Guryanova, Anastasia A., Simonov, Alexander M., Raevskiy, Mikhail M., Efimov, Victor V., Wang, Ye, Sekacheva, Marina I., Garazha, Andrew V., Borisov, Nicolas M., Kuzmin, Denis V., Sorokin, Maxim I., Buzdin, Anton A.
Publicado 2022

Automated characterisation of neutrophil activation phenotypes in ex vivo human Candida blood infections

por Belyaev, Ivan, Marolda, Alessandra, Praetorius, Jan-Philipp, Sarkar, Arjun, Medyukhina, Anna, Hünniger, Kerstin, Kurzai, Oliver, Figge, Marc Thilo
Publicado 2022

A comprehensive evaluation of the potential binding poses of fentanyl and its analogs at the µ-opioid receptor

por Xie, Bing, Goldberg, Alexander, Shi, Lei
Publicado 2022

Artificial intelligence predictive system of individual survival rate for lung adenocarcinoma

por He, Tingshan, Li, Jing, Wang, Peng, Zhang, Zhiqiao
Publicado 2022