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ports/science/cpcmx
Älven 34452b5aae science/cpcmx: [NEW PORT] Extended conductor-like polarizable continuum solvation model
This is an fully Free Software solvation model, based on the original
conductor like screening model for realistic solvation (COSMO-RS)
model by Klamt et al. in combination with the universal solvation
model based on solute electron density (SMD): by Marenich, Cramer and
Truhlar.

WWW: https://github.com/grimme-lab/CPCM-X/

Reviewed by:		diizzy@
Approved by:		yuri@ (Mentor)
Differential Revision:	https://reviews.freebsd.org/D53531
2025-11-03 16:56:01 +04:00
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