Instruct: Identify the main and secondary category of Arxiv papers based on the titles and abstracts
Query: Ivermectin and Doxycycline Combination as a Promising Drug Candidate
  Against SARS-CoV-2 Infection: A Computational Study   In the present study, we have described how by using molecular docking and
molecular dynamic (MD) simulation studies the combination drug of ivermectin
and doxycycline can be used as a potential inhibitor for SARS-CoV-2 virus. In
lieu of unavailability of specific cure of COVID-19 till now various
possibilities for individual and combination drugs have been explored by the
medical practitioners/scientists for the remedial purpose of CoV-2 infections.
$3CL^{pro}$ is the main protease of SARS-CoV-2 virus which plays an essential
role in mediating viral replication in the human body. $3CL^{pro}$ protein can
serve as an attractive drug target. In this work, we have studied drug:
$3CL^{pro}$ interactions by in silico molecular docking and MD simulation
approaches. Common and easily available antiviral drugs ivermectin, doxycycline
and their combination have been proved their valid candidature to be used as
potential drug candidates against SARS-CoV-2 infections.

33
The categories of this paper are: plasm-ph
5
The categories of this paper are: gr-qc
13
The categories of this paper are: quant-ph
32
The categories of this paper are: atom-ph
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The categories of this paper are: chem-ph
17
The categories of this paper are: q-fin
8
The categories of this paper are: hep-ex
12
The categories of this paper are: nucl-th
14
The categories of this paper are: math-ph
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The categories of this paper are: q-alg
24
The categories of this paper are: dg-ga
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The categories of this paper are: cmp-lg
23
The categories of this paper are: solv-int
27
The categories of this paper are: comp-gas
26
The categories of this paper are: bayes-an
21
The categories of this paper are: adap-org