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Molecular Simulation Volume 44, 2018 - Issue 3
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Articles

Structural insights into Rab21 GTPase activation mechanism by molecular dynamics simulations

Mohd. ShahbaazDepartment of Chemistry, Durban University of Technology, Durban, South Africa
,
Mohd. AmirCenter for Interdisciplinary Research in Basic Sciences, Jamia Millia Islamia, New Delhi, India
,
Safikur RahmanDepartment of Medical Biotechnology, Yeungnam University, Gyeongsan, South Korea
,
Gulam Mustafa HasanDepartment of Biochemistry, College of Medicine, Prince Sattam Bin Abdulaziz University, Al-Kharj, Saudi Arabia
,
Ravins DohareCenter for Interdisciplinary Research in Basic Sciences, Jamia Millia Islamia, New Delhi, India
,
Krishna BisettyDepartment of Chemistry, Durban University of Technology, Durban, South Africa
,
Faizan AhmadCenter for Interdisciplinary Research in Basic Sciences, Jamia Millia Islamia, New Delhi, India
,
Jihoe KimDepartment of Medical Biotechnology, Yeungnam University, Gyeongsan, South KoreaCorrespondence[email protected]
&
Md. Imtaiyaz HassanCenter for Interdisciplinary Research in Basic Sciences, Jamia Millia Islamia, New Delhi, IndiaCorrespondence[email protected]
ORCID Iconhttp://orcid.org/0000-0002-3663-4940
ORCID Icon show all
Pages 179-189 | Received 29 Oct 2016, Accepted 15 Jul 2017, Published online: 31 Jul 2017

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Subodh Kumar, Somya Chaaudhary, Prateek Paul & Yogesh Kumar Verma. (2023) Exploring STAT3 stimulatory potential of novel wound healing molecules by virtual screening and molecular dynamics simulations. Journal of Biomolecular Structure and Dynamics 41:17, pages 8292-8306.
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Nilima Rani Das, Tripti Sharma, Andrey A. Toropov, Alla P. Toropova, Manish Kumar Tripathi & P. Ganga Raju Achary. (2023) Machine-learning technique, QSAR and molecular dynamics for hERG–drug interactions. Journal of Biomolecular Structure and Dynamics 0:0, pages 1-26.
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Mohd. Amir, Shahzaib Ahamad, Taj Mohammad, Deeba Shamim Jairajpuri, Gulam Mustafa Hasan, Ravins Dohare, Asimul Islam, Faizan Ahmad & Md. Imtaiyaz Hassan. (2021) Investigation of conformational dynamics of Tyr89Cys mutation in protection of telomeres 1 gene associated with familial melanoma. Journal of Biomolecular Structure and Dynamics 39:1, pages 35-44.
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Ahmad Abu Turab Naqvi, Deeba Shamim Jairajpuri, Omar Mohammed Ali Noman, Afzal Hussain, Asimul Islam, Faizan Ahmad, Mohammed F. Alajmi & Md. Imtaiyaz Hassan. (2020) Evaluation of pyrazolopyrimidine derivatives as microtubule affinity regulating kinase 4 inhibitors: Towards therapeutic management of Alzheimer’s disease. Journal of Biomolecular Structure and Dynamics 38:13, pages 3892-3907.
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Mohd. Amir, Shahnawaz Ahmad, Shahzaib Ahamad, Vijay Kumar, Taj Mohammad, Ravins Dohare, Mohamed F. Alajmi, Tabish Rehman, Afzal Hussain, Asimul Islam, Faizan Ahmad & Md. Imtaiyaz Hassan. (2020) Impact of Gln94Glu mutation on the structure and function of protection of telomere 1, a cause of cutaneous familial melanoma. Journal of Biomolecular Structure and Dynamics 38:5, pages 1514-1524.
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