E. Demchuk

发表

Nearest‐neighbor nonparametric method for estimating the configurational entropy of complex molecules

Harshinder Singh, Vladimir Hnizdo, Adam Fedorowicz, 2007, J. Comput. Chem..

Statistical thermodynamics of internal rotation in a hindering potential of mean force obtained from computer simulations

Harshinder Singh, Vladimir Hnizdo, Adam Fedorowicz, 2003, J. Comput. Chem..

Estimation of the entropy of a multivariate normal distribution

Harshinder Singh, Neeraj Misra, E. Demchuk, 2005 .

Nearest Neighbor Estimates of Entropy

Harshinder Singh, Neeraj Misra, V. Hnizdo, 2003 .

Improving the Continuum Dielectric Approach to Calculating pKas of Ionizable Groups in Proteins

Rebecca C. Wade, Eugene Demchuk, R. Wade, 1996 .

Probabilistic model for two dependent circular variables

Harshinder Singh, Eugene Demchuk, Vladimir Hnizdo, 2002 .

Impact of Silanol Surface Density on the Toxicity of Silica Aerosols Measured by Erythrocyte Haemolysis

E. Demchuk, M. Harper, V. Murashov, 2006, Journal of occupational and environmental hygiene.

Surface sites and unrelaxed surface energies of tetrahedral silica polymorphs and silicate

E. Demchuk, V. Murashov, 2005 .

Theoretical and Computational Challenges in Entropy Evaluation of Macromolecules

V. Hnizdo, E. Demchuk, H. Singh, 2001 .

A comparative study of unrelaxed surfaces on quartz and kaolinite, using the periodic density functional theory.

E. Demchuk, V. Murashov, 2005, The journal of physical chemistry. B.

Immunogenetic factors in beryllium sensitization and chronic beryllium disease.

Christine R. Schuler, E. Demchuk, M. Andrew, 2005, Mutation research.

Reconstruction of the (011) surface on α-quartz: A semiclassical Ab initio molecular dynamics study

Alexander D. MacKerell, Pedro E. M. Lopes, E. Demchuk, 2009 .

Statistical thermodynamics of hindered rotation from computer simulations

Harshinder Singh, Eugene Demchuk, Harshinder Singh, 2001 .

Electrostatic potential on human leukocyte antigen: implications for putative mechanism of chronic beryllium disease.

E. Demchuk, A. Weston, S. Tinkle, 2003, Environmental health perspectives.

Development of an empirical force field for silica. Application to the quartz-water interface.

Alexander D. MacKerell, Pedro E. M. Lopes, Vladimir Murashov, 2006, The journal of physical chemistry. B.

Topographical organization of the N-terminal segment of lung pulmonary surfactant protein B (SP-B(1-25)) in phospholipid bilayers.

E. Demchuk, K. M. Rao, Yudong Wang, 2003, Biochemistry.

MODELING 3-DIMENSIONAL STRUCTURE AND ELECTROSTATICS OF ALKALI-STABLE CYCLOMALTODEXTRIN GLUCANOTRANSFERASE

R. Wade, E. Demchuk, M. Vihinen, 1993 .

Estimation of the absolute internal‐rotation entropy of molecules with two torsional degrees of freedom from stochastic simulations

Harshinder Singh, Vladimir Hnizdo, Adam Fedorowicz, 2005, J. Comput. Chem..