Works matching IS 01928651 AND DT 2017 AND VI 38 AND IP 23
Results: 10
Incorporating deep learning with convolutional neural networks and position specific scoring matrices for identifying electron transport proteins.
- Published in:
- Journal of Computational Chemistry, 2017, v. 38, n. 23, p. 2000, doi. 10.1002/jcc.24842
- By:
- Publication type:
- Article
Efficient estimation of binding free energies between peptides and an MHC class II molecule using coarse-grained molecular dynamics simulations with a weighted histogram analysis method.
- Published in:
- Journal of Computational Chemistry, 2017, v. 38, n. 23, p. 2007, doi. 10.1002/jcc.24845
- By:
- Publication type:
- Article
On low-lying excited states of extended nanographenes.
- Published in:
- Journal of Computational Chemistry, 2017, v. 38, n. 23, p. 2020, doi. 10.1002/jcc.24846
- By:
- Publication type:
- Article
Calculation of photoionization differential cross sections using complex Gauss-type orbitals.
- Published in:
- Journal of Computational Chemistry, 2017, v. 38, n. 23, p. 2030, doi. 10.1002/jcc.24848
- By:
- Publication type:
- Article
Rapid and accurate assessment of GPCR-ligand interactions Using the fragment molecular orbital-based density-functional tight-binding method.
- Published in:
- Journal of Computational Chemistry, 2017, v. 38, n. 23, p. 1987, doi. 10.1002/jcc.24850
- By:
- Publication type:
- Article
Issue Information.
- Published in:
- Journal of Computational Chemistry, 2017, v. 38, n. 23, p. 1981, doi. 10.1002/jcc.24640
- Publication type:
- Article
Accurate van der Waals force field for gas adsorption in porous materials.
- Published in:
- Journal of Computational Chemistry, 2017, v. 38, n. 23, p. 1991, doi. 10.1002/jcc.24832
- By:
- Publication type:
- Article
Cover Image, Volume 38, Issue 23.
- Published in:
- Journal of Computational Chemistry, 2017, v. 38, n. 23, p. i, doi. 10.1002/jcc.24889
- Publication type:
- Article
Nitrogen-doped C<sub>60</sub> as a robust catalyst for CO oxidation.
- Published in:
- Journal of Computational Chemistry, 2017, v. 38, n. 23, p. 2041, doi. 10.1002/jcc.24851
- By:
- Publication type:
- Article
Tinker-OpenMM: Absolute and relative alchemical free energies using AMOEBA on GPUs.
- Published in:
- Journal of Computational Chemistry, 2017, v. 38, n. 23, p. 2047, doi. 10.1002/jcc.24853
- By:
- Publication type:
- Article