- RM1 software
- Recent articles
- RM1 research topics
- QSAR
- Barrier height
- Calixarene
- Cavitand
- CI
- Charges
- DNA/RNA
- Drug design
- Geometry
- Heats
- Hydrogen bond RM1_BH
- Host-guest
- Isotope effect
- Langmuir
- Lanthanides
- NMR
- Nanostructures
- Nonlinear optics
- Photochemistry
- pKa
- Proteins
- Proton transfer
- QM/MM
- Rare earth metals
- RM1/AM1
- Self-assembly
- Solvation
- Vibrations
- Books
- FAQ
- Sponsors
- Contact
Charges
RM1: A reparameterization of AM1 for H, C, N, O, P, S, F, Cl, Br, and I
Author(s): Rocha GB (Rocha, Gerd B.), Freire RO (Freire, Ricardo O.), Simas AM (Simas, Alfredo M.), Stewart JJP (Stewart, James J. P.)
Publication year: 2006
Journal / Book title: JOURNAL OF COMPUTATIONAL CHEMISTRY
Excerpt from page 1104 of the article:


