Additive CHARMM Force Field for Naturally Occurring Modified Ribonucleotides.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 9/10, p. 896, doi. 10.1002/jcc.24307
- By:
- Publication type:
- Article
Works matching IS 01928651 AND DT 2016 AND VI 37 AND IP 9/10
Results: 8
1
2
Possible Mechanism of BN Fullerene Formation from a Boron Cluster: Density-Functional Tight-Binding Molecular Dynamics Simulations.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 9/10, p. 886, doi. 10.1002/jcc.24287
- By:
- Publication type:
- Article
3
On the Zeroth-Order Hamiltonian for CASPT2 Calculations of Spin Crossover Compounds.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 9/10, p. 947, doi. 10.1002/jcc.24283
- By:
- Publication type:
- Article
4
A Mixed DFT-MD Methodology for the In Silico Development of Drug Releasing Macrocycles. Calix and Thia-Calix[N]Arenes as Carriers for Bosutinib and Sorafenib.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 9/10, p. 940, doi. 10.1002/jcc.24281
- By:
- Publication type:
- Article
5
Parallelization and Improvements of the Generalized Born Model with a Simple sWitching Function for Modern Graphics Processors.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 9/10, p. 927, doi. 10.1002/jcc.24280
- By:
- Publication type:
- Article
6
Implicit Solvent Coarse-Grained Model of Polyamidoamine Dendrimers: Role of Generation and pH.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 9/10, p. 920, doi. 10.1002/jcc.24277
- By:
- Publication type:
- Article
7
The Role of Protein "Stability Patches" in Molecular Recognition: A Case Study of the Human Growth Hormone-Receptor Complex.
- Published in:
- 2016
- By:
- Publication type:
- Case Study
8
The Hydration Properties of Carboxybetaine Zwitterion Brushes.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 9/10, p. 877, doi. 10.1002/jcc.24234
- By:
- Publication type:
- Article