Zafar, Atif <br/><br/>
Novel Non-Peptide Inhibitors against SmCL1 of Schistosoma mansoni: In Silico Elucidation, Implications and Evaluation via Knowledge Based Drug Discovery.  [electronic resource] 

 -  PloS one  2015 
 - e0123996 p.  digital 
<br/><br/> Publication Type: Journal Article 
<br/><br/><label>ISSN: </label>1932-6203 
<br/><br/><label>Standard No.: </label>10.1371/journal.pone.0123996  doi 
<br/><br/><label>Subjects--Topical Terms: </label><br/>Algorithms<br/>Amino Acid Sequence<br/>Animals<br/>Anthelmintics--chemistry<br/>Catalytic Domain<br/>Cathepsins--antagonists & inhibitors<br/>Computer Simulation<br/>Drug Discovery<br/>Drug Evaluation, Preclinical<br/>Helminth Proteins--antagonists & inhibitors<br/>Hydrogen Bonding<br/>Knowledge<br/>Ligands<br/>Molecular Dynamics Simulation<br/>Molecular Sequence Data<br/>Peptides--pharmacology<br/>Protease Inhibitors--chemistry<br/>ROC Curve<br/>Reproducibility of Results<br/>Schistosoma mansoni--drug effects<br/>Sequence Alignment<br/>Sequence Homology, Amino Acid<br/>Static Electricity<br/>Structure-Activity Relationship<br/>Thermodynamics