GBISParamStruct Struct Reference

#include <ComputeNonbondedUtil.h>

List of all members.

Public Attributes

int cid
int patchID [2]
int sequence
int doSmoothing
int doGBIS
int numPatches
int gbisPhase
RealintRad [2]
GBRealpsiSum [2]
RealbornRad [2]
GBRealdEdaSum [2]
RealdHdrPrefix [2]
BigReal epsilon_s
BigReal epsilon_p
BigReal rho_0
BigReal kappa
BigReal cutoff
BigReal a_cut
BigReal fsMax
BigReal delta
BigReal beta
BigReal gamma
BigReal alpha_max
BigReal gbSelfEnergy
BigReal gbInterEnergy
int doFullElectrostatics
int doEnergy
PairlistsgbisStepPairlists [4]
BigReal maxGroupRadius

Detailed Description

Definition at line 158 of file ComputeNonbondedUtil.h.


Member Data Documentation


The documentation for this struct was generated from the following file:

Generated on 19 Sep 2020 for NAMD by  doxygen 1.6.1