Simple Predictive Models of Passive Membrane Permeability Incorporating Size-Dependent Membrane-Water Partition

Journal of Chemical Information and Modeling

Volumn 56, Issue 5, 2016, Pages 924-929

  Leung, Siegfried S F ^a   Sindhikara, Daniel ^b   Jacobson, Matthew P ^a  

^a UNIVERSITY OF CALIFORNIA   (United States)

^b SCHRÖDINGER INC   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

LINEAR REGRESSION;

CONFORMATIONAL SEARCH; DIFFUSION THEORY; MEMBRANE PERMEABILITY; MULTIPLE LINEAR REGRESSION ANALYSIS; PERMEABILITY PREDICTION; PREDICTIVE MODELS; RELATIVE CONTRIBUTION; WEAK CORRELATION;

PREDICTIVE ANALYTICS;

WATER;

ANIMAL; CELL MEMBRANE; CELL MEMBRANE PERMEABILITY; CONFORMATION; DIFFUSION; DOG; MDCK CELL LINE; METABOLISM; MOLECULAR MODEL; SOLUBILITY; STATISTICAL MODEL; THERMODYNAMICS;

ANIMALS; CELL MEMBRANE; CELL MEMBRANE PERMEABILITY; DIFFUSION; DOGS; LINEAR MODELS; MADIN DARBY CANINE KIDNEY CELLS; MODELS, MOLECULAR; MOLECULAR CONFORMATION; SOLUBILITY; THERMODYNAMICS; WATER;

EID: 84971268704     PISSN: 15499596     EISSN: 1549960X     Source Type: Journal    
DOI: 10.1021/acs.jcim.6b00005     Document Type: Article

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