PyPI page
Home page
Author:
None
Summary:
Electrostatic Map Suite - A Comprehensive Set of Calculators for Qualifying and Quantifying Electrostatic Interactions and Effects.
Latest version:
1.0.5
Required dependencies:
apbs-binary
|
geometric
|
numpy
|
pyscf
|
ray
|
rdkit
|
requests
|
vdw-surfgen
Optional dependencies:
cupy-cuda12x
|
cutensor-cu12
|
gpu4pyscf-cuda12x
|
gpu4pyscf-libxc-cuda12x
Downloads last day:
4
Downloads last week:
12
Downloads last month:
29