Shukla, Rohit <br/><br/>
Identification of potential inhibitors of Fasciola gigantica thioredoxin1: computational screening, molecular dynamics simulation, and binding free energy studies.  [electronic resource] 

 -  Journal of biomolecular structure & dynamics  Jun 2018 
 - 2147-2162 p.  digital 
<br/><br/> Publication Type: Journal Article 
<br/><br/><label>ISSN: </label>1538-0254 
<br/><br/><label>Standard No.: </label>10.1080/07391102.2017.1344141  doi 
<br/><br/><label>Subjects--Topical Terms: </label><br/>Amino Acid Sequence<br/>Animals<br/>Biological Products--chemistry<br/>Drug Evaluation, Preclinical<br/>Fasciola--genetics<br/>Helminth Proteins--antagonists & inhibitors<br/>Ligands<br/>Molecular Docking Simulation<br/>Molecular Dynamics Simulation<br/>Molecular Structure<br/>Protein Binding<br/>Protein Domains<br/>Sequence Homology, Amino Acid<br/>Thermodynamics<br/>Thioredoxins--antagonists & inhibitors