Correction to Capturing the Crystal: Prediction of ... - ACS Publications

Correction to Capturing the Crystal: Prediction of Enthalpy of

fus rot. (6). Published: February 27, 2013. Erratum pubs.acs.org/jcim. Â© 2013 American Chemical Society. 737 dx.doi.org/10.1021/ci400111g | J. Chem.

Correction to Capturing the Crystal: Prediction of Enthalpy of

Correction to Capturing the Crystal: Prediction of Enthalpy of Sublimation, Crystal Lattice Energy, and Melting Points of Organic Compounds.

Capturing the Crystal: Prediction of Enthalpy of Sublimation, Crystal

Dec 10, 2012 - We report robust, predictive, quantitative structureâproperty relationship (QSPR) models for enthalpies of sublimation, crystal lattice energies, and melting points for a very large and structurally diverse set of small organic compo

Capturing the Crystal: Prediction of Enthalpy of Sublimation, Crystal

Dec 10, 2012 - Capturing the Crystal: Prediction of Enthalpy of Sublimation, Crystal Lattice Energy, and Melting Points of Organic Compounds.

Capturing the Crystal: Prediction of Enthalpy of ... - Semantic Scholar

Dec 10, 2012 - Given the size and diversity of the training data, these conceptually transparent and ... molecular mechanics,9 quantum mechanical calculations,10,11 quantitative .... Plot of the predicted versus experimental values of sublimation ent

Correction to Acute Toxicity Prediction to ... - ACS Publications

Nov 16, 2016 - Oak Ridge Institute for Science and Education, U.S. Environmental Protection Agency, Gulf Ecology Division, 1 Sabine Island Drive,. Gulf Breeze, Florida 32561, United States. â¡. U.S. Environmental Protection Agency, National Health a

Correction to Prediction of Stable Nitride Perovskites - ACS Publications

Nov 5, 2015 - Rafael Sarmiento-PÃ©rez, Tiago F. T. Cerqueira, Sabine KÃ¶rbel, Silvana Botti,* and Miguel A. L. Marques*. Chem. Mater. 2015, 27 (17) ...

Correction to âPrediction of Ocular Drug ... - ACS Publications

Mar 16, 2017 - Correction to âPrediction of Ocular Drug Distribution from Systemic Blood Circulationâ. Kati-Sisko Vellonen, Esa-Matti Soini, Eva M. del Amo, ...

Correction to Identification of Descriptors Capturing Compound Class

Feb 3, 2011 - MI-DSE(D) = Hnorm(D) r. HA(D)+ HB(D). 2. (9). Pages 1936r1939: We have noticed plotting/labeling errors in individual histograms in Figures ...

Correction to Identification of Descriptors Capturing Compound Class

Feb 3, 2011 - Department of Life Science Informatics, B-IT, Rheinische-Friedrich-Wilhelms-UniversitÃ¤t, Dahlmannstrasse 2, D-53113 Bonn, Germany.

Correction to Capturing the Crystal: Prediction of ... - ACS Publications

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