Identification of potential cruzain inhibitors using de novo design, molecular docking and dynamics simulations studies

被引：5

作者：

Bhowmick, Shovonlal ^{[1
]}

Chorge, Rekha Dhondiram ^{[2
]}

Jangam, Chaitanya Sadashiv ^{[2
]}

Bharatrao, Lomate Dhanraj ^{[2
]}

Patil, Pritee Chunarkar ^{[2
]}

Chikhale, Rupesh V. ^{[3
]}

Islam, Md. Ataul ^{[4
,5
,6
,7
]}

机构：

[1] Univ Calcutta, Dept Chem Technol, Kolkata, India

[2] Bharati Vidyapeeth Deemed Univ, Rajiv Gandhi Inst IT & Biotechnol, Dept Bioinformat, Pune, Maharashtra, India

[3] Univ East Anglia, Sch Pharm, Norwich, Norfolk, England

[4] Univ Manchester, Fac Biol Med & Hlth, Sch Hlth Sci, Div Pharm & Optometry, Oxford Rd, Manchester M13 9PL, Lancs, England

[5] Univ Kwazulu Natal, Sch Hlth Sci, Durban, South Africa

[6] Univ Pretoria, Fac Hlth Sci, Dept Chem Pathol, Pretoria, South Africa

[7] Tshwane Acad Div, Natl Hlth Lab Serv, Pretoria, South Africa

来源：

JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS | 2020年 / 38卷 / 13期

关键词：

CHAGAS-DISEASE;

D O I：

10.1080/07391102.2019.1664334

中图分类号：

Q5 [生物化学]; Q7 [分子生物学];

学科分类号：

071010 ; 081704 ;

摘要：

引用

页码：4005 / 4015

页数：11

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