Novel computer program for fast exact calculation of accessible and molecular surface areas and average surface curvature

By O. Tsodikov, M. Record, Y. Sergeev. Journal of Computational Chemistry, 2002

374 citations recorded by the source corpus.

Subfields: Atomic and Molecular Physics, and Optics, Materials Chemistry, Molecular Biology

View Paper: https://www.semanticscholar.org/paper/32ade75f7fdcb422b02683eb72b04f6f3378296c

How researchers see this paper

The researchers whose trusted networks rank it highest, strongest advocate first. Every researcher gets a different order.

In Atomic and Molecular Physics, and Optics

1. Cheng Soon Ong

In Materials Chemistry

1. S. V. N. Vishwanathan
2. Karsten M. Borgwardt
3. Alex Smola

In Molecular Biology

1. Alex Smola
2. Karsten M. Borgwardt
3. S. V. N. Vishwanathan
4. Hans-Peter Kriegel
5. Cheng Soon Ong
6. Arthur Gretton
7. Wouter M. Kouw
8. Nicholas Carlini

Citations in the corpus

• Protein function prediction via graph kernels (2005, background): “…are the same for all nodes in one graph; they represent the existence of ligands, the number of disulphide bonds, the size of the largest surface pocket (Binkowski et al., 2003) and the fraction of each AA type on the protein surface (Tsodikov et al., 2002), analogous to Dobson and Doig (2003).”