ORIGINAL RESEARCH
Published on 27 May 2020
Theoretical Exploring Selective-Binding Mechanisms of JAK3 by 3D-QSAR, Molecular Dynamics Simulation and Free Energy Calculation
doi 10.3389/fmolb.2020.00083
- 2,641 views
- 13 citations
- Frontiers in Molecular Biosciences
- Molecular Recognition
- Research Topics
- Free Energy Calculation: Current Paradigms and Applications for Drug Discovery
Free Energy Calculation: Current Paradigms and Applications for Drug Discovery
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Articles
ORIGINAL RESEARCH
Published on 15 Apr 2020
Molecular Mechanism of Selective Binding of NMS-P118 to PARP-1 and PARP-2: A Computational Perspective
doi 10.3389/fmolb.2020.00050
- 3,326 views
- 15 citations
HYPOTHESIS AND THEORY
Published on 09 Apr 2020
Gibbs Free Energy Calculation of Mutation in PncA and RpsA Associated With Pyrazinamide Resistance
doi 10.3389/fmolb.2020.00052
- 11,290 views
- 19 citations
BRIEF RESEARCH REPORT
Published on 31 Mar 2020
Identification of NUDT5 Inhibitors From Approved Drugs
doi 10.3389/fmolb.2020.00044
- 3,390 views
- 11 citations
ORIGINAL RESEARCH
Published on 06 Mar 2020
Exploring the Activation Mechanism of the mGlu5 Transmembrane Domain
doi 10.3389/fmolb.2020.00038
- 3,557 views
- 7 citations
ORIGINAL RESEARCH
Published on 28 Jan 2020
Inhibition Mechanism of Indoleamine 2, 3-Dioxygenase 1 (IDO1) by Amidoxime Derivatives and Its Revelation in Drug Design: Comparative Molecular Dynamics Simulations
doi 10.3389/fmolb.2019.00164
- 5,759 views
- 7 citations
BRIEF RESEARCH REPORT
Published on 23 Jan 2020
Characterizing the Binding Sites for GK Domain of DLG1 and DLG4 via Molecular Dynamics Simulation
doi 10.3389/fmolb.2020.00001
- 3,194 views
- 52 citations
ORIGINAL RESEARCH
Published on 09 Jan 2020
Glucose-6-Phosphate Upregulates Txnip Expression by Interacting With MondoA
doi 10.3389/fmolb.2019.00147
- 3,809 views
- 7 citations
