A geometry force field which converts low-resolution X-ray models to structures with properties found at ultra high resolution

Protein Science

Volumn 21, Issue 1, 2012, Pages 75-83

  McMartin, Colin ^a  

^a Thistlesoft   (United States)

Author keywords

Accurate geometry; B factor; Geometry force field; Geometry optimization; Hydrogen bonding; Ligand force field; Van der Waals contact; Water addition

Indexed keywords

ARTICLE; CHEMICAL ANALYSIS; GEOMETRY; HYDROGEN BOND; IMAGE DISPLAY; PRIORITY JOURNAL; X RAY;

COMPUTER SIMULATION; CRYSTALLOGRAPHY, X-RAY; HIV PROTEASE; HYDROGEN BONDING; MODELS, MOLECULAR; PROTEIN CONFORMATION; PROTEINS; WATER;

EID: 84455168022     PISSN: 09618368     EISSN: 1469896X     Source Type: Journal    
DOI: 10.1002/pro.760     Document Type: Article

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