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Issue Information.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 22, p. 2039, doi. 10.1002/jcc.24097
- Publication type:
- Article
Using the gini coefficient to measure the chemical diversity of small-molecule libraries.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 22, p. 2091, doi. 10.1002/jcc.24423
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- Publication type:
- Article
Novel enhanced applications of QSPR models: Temperature dependence of aqueous solubility.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 22, p. 2045, doi. 10.1002/jcc.24424
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- Publication type:
- Article
Efficient determination of accurate atomic polarizabilities for polarizeable embedding calculations.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 22, p. 2052, doi. 10.1002/jcc.24425
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- Publication type:
- Article
A polarizable, charge transfer model of water using the drude oscillator.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 22, p. 2060, doi. 10.1002/jcc.24426
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- Publication type:
- Article
Torque and atomic forces for Cartesian tensor atomic multipoles with an application to crystal unit cell optimization.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 22, p. 2067, doi. 10.1002/jcc.24427
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- Publication type:
- Article
CarbBuilder: Software for building molecular models of complex oligo- and polysaccharide structures.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 22, p. 2098, doi. 10.1002/jcc.24428
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- Publication type:
- Article
Accurate Kohn-Sham ionization potentials from scaled-opposite-spin second-order optimized effective potential methods.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 22, p. 2081, doi. 10.1002/jcc.24436
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- Publication type:
- Article
molSimplify: A toolkit for automating discovery in inorganic chemistry.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 22, p. 2106, doi. 10.1002/jcc.24437
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- Publication type:
- Article
Cover Image, Volume 37, Issue 22.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 22, p. i, doi. 10.1002/jcc.24454
- Publication type:
- Article