Volume 80

Computational Biology and Chemistry

Volume 80

1

On the characterization of novel biologically active steroids: Selection of lipophilicity models of newly synthesized steroidal derivatives by classical and non-parametric ranking approaches

Karadžić Banjac, Milica Ž., Kovačević, Strahinja Z., Jevrić, Lidija R., Podunavac-Kuzmanović, Sanja O., Mandić, Anamarija I.

Journal:

Computational Biology and Chemistry

Année:

2019

Langue:

english

Fichier:

PDF, 474 KB

english, 2019

2

Assessment of structurally and functionally high-risk nsSNPs impacts on human bone morphogenetic protein receptor type IA (BMPR1A) by computational approach

Islam, Md. Jahirul, Parves, Md. Rimon, Mahmud, Shafi, Tithi, Fahmida Alam, Reza, Md. Abu

Journal:

Computational Biology and Chemistry

Année:

2019

Langue:

english

Fichier:

PDF, 2.23 MB

english, 2019

3

Predicting drug-target interaction network using deep learning model

You, Jiaying, McLeod, Robert D., Hu, Pingzhao

Journal:

Computational Biology and Chemistry

Année:

2019

Fichier:

PDF, 780 KB

2019

4

Identification of novel Plasmodium falciparum PI4KB inhibitors as potential anti-malarial drugs: Homology modeling, molecular docking and molecular dynamics simulations

Ibrahim, Mahmoud A.A., Abdelrahman, Alaa H.M., Hassan, Alaa M.A.

Journal:

Computational Biology and Chemistry

Année:

2019

Fichier:

PDF, 2.65 MB

2019

5

Identification of novel Plasmodium falciparum PI4KB inhibitors as potential anti-malarial drugs: Homology modeling, molecular docking and molecular dynamics simulations

Ibrahim, Mahmoud A.A., Abdelrahman, Alaa H.M., Hassan, Alaa M.A.

Journal:

Computational Biology and Chemistry

Année:

2019

Langue:

english

Fichier:

PDF, 2.65 MB

english, 2019

6

Interspersed 5′cis-regulatory elements ascertain the spatio-temporal transcription of cytoskeletal profilin gene family in Arabidopsis

Upadhyay, Arnav K., Arora, Sakshi, Pandey, Dhananjay K., Chaudhary, Bhupendra

Journal:

Computational Biology and Chemistry

Année:

2019

Fichier:

PDF, 637 KB

2019

7

Combination of pharmacophore modeling and 3D-QSAR analysis of potential glyoxalase-I inhibitors as anticancer agents

Al-Sha'er, Mahmoud A., Al-Balas, Qosay A., Hassan, Mohammad A., Al Jabal, Ghazi A., Almaaytah, Ammar M.

Journal:

Computational Biology and Chemistry

Année:

2019

Langue:

english

Fichier:

PDF, 1017 KB

english, 2019

8

Identifying mutated driver pathways in cancer by integrating multi-omics data

Wu, Jingli, Cai, Qirong, Wang, Jinyan, Liao, Yuanxiu

Journal:

Computational Biology and Chemistry

Année:

2019

Fichier:

PDF, 1.84 MB

2019

9

Interspersed 5′cis-regulatory elements ascertain the spatio-temporal transcription of cytoskeletal profilin gene family in Arabidopsis

Upadhyay, Arnav K., Arora, Sakshi, Pandey, Dhananjay K., Chaudhary, Bhupendra

Journal:

Computational Biology and Chemistry

Année:

2019

Langue:

english

Fichier:

PDF, 637 KB

english, 2019

10

G-rich VEGF aptamer as a potential inhibitor of chitin trafficking signal in emerging opportunistic yeast infection

Vahed, Mohammad, Ahmadian, Gholamreza, Ameri, Niyoosha, Vahed, Majid

Journal:

Computational Biology and Chemistry

Année:

2019

Fichier:

PDF, 3.59 MB

2019

11

Prediction and molecular insights into fungal adhesins and adhesin like proteins

Journal:

Computational Biology and Chemistry

Année:

2019

Langue:

english

Fichier:

PDF, 848 KB

english, 2019

12

Systematic Profiling and Evaluation of Structure-based Kinase–Inhibitor Interactome in Cervical Cancer by Integrating In Silico Analyses and In Vitro Assays at Molecular and Cellular Levels

Zhu, Li-Xia, Liu, Qin, Hua, Ya-Fang, Yang, Ning, Zhang, Xue-Gang, Ding, Xi

Journal:

Computational Biology and Chemistry

Année:

2019

Langue:

english

Fichier:

PDF, 2.98 MB

english, 2019

13

Structure based pharmacophore study to identify possible natural selective PARP-1 trapper as anti-cancer agent

Kumar, Chandan, P.T.V., Lakshmi, Arunachalam, Annamalai

Journal:

Computational Biology and Chemistry

Année:

2019

Langue:

english

Fichier:

PDF, 5.28 MB

english, 2019

14

Genome-wide Analysis of the MADS-Box Gene Family in Watermelon

Wang, Ping, Wang, Songbo, Chen, Yong, Xu, Xiaomin, Guang, Xuanmin, Zhang, Youhua

Journal:

Computational Biology and Chemistry

Année:

2019

Fichier:

PDF, 1.03 MB

2019

15

Drug promiscuity: Exploring the polypharmacology potential of 1, 3, 6-trisubstituted 1, 4-diazepane-7-ones as an inhibitor of the ‘god father’ of immune checkpoint

Soremekun, Opeyemi S., Olotu, Fisayo A., Agoni, Clement, Soliman, Mahmoud E.S.

Journal:

Computational Biology and Chemistry

Année:

2019

Langue:

english

Fichier:

PDF, 2.38 MB

english, 2019

16

Gene selection of rat hepatocyte proliferation using adaptive sparse group lasso with weighted gene co-expression network analysis

Li, Juntao, Wang, Yadi, Xiao, Huimin, Xu, Cunshuan

Journal:

Computational Biology and Chemistry

Année:

2019

Langue:

english

Fichier:

PDF, 1.77 MB

english, 2019

17

HIVCoR: A sequence-based tool for predicting HIV-1 CRF01_AE coreceptor usage

Hongjaisee, Sayamon, Nantasenamat, Chanin, Carraway, Tanawan Samleerat, Shoombuatong, Watshara

Journal:

Computational Biology and Chemistry

Année:

2019

Langue:

english

Fichier:

PDF, 3.58 MB

english, 2019

18

THPep: A machine learning-based approach for predicting tumor homing peptides

Shoombuatong, Watshara, Schaduangrat, Nalini, Pratiwi, Reny, Nantasenamat, Chanin

Journal:

Computational Biology and Chemistry

Année:

2019

Langue:

english

Fichier:

PDF, 1.53 MB

english, 2019

19

Structural prediction, whole exome sequencing and molecular dynamics simulation confirms p.G118D somatic mutation of PIK3CA as functionally important in breast cancer patients

Masoodi, Tariq Ahmad, Shaik, Noor Ahmad, Burhan, Syed, Hasan, Qurratulain, Shafi, Gowhar, Talluri, Venkateswara Rao

Journal:

Computational Biology and Chemistry

Année:

2019

Langue:

english

Fichier:

PDF, 800 KB

english, 2019

20

Virtual screening of p53 mutants reveals Y220S as an additional rescue drug target for PhiKan083 with higher binding characteristics

Raghavan, Vaijayanthi, Agrahari, Maulishree, Gowda, Dhananjaya Kale

Journal:

Computational Biology and Chemistry

Année:

2019

Fichier:

PDF, 2.90 MB

2019