234235236237238239240241242243244
if(concnA>0.0D || concnB>0.0)this.nonZeroConcns++; this.arrayl.add(new Double(assocK)); if(assocK!=0.0D)this.nonZeroAssocK++; double rad = 0.0D; if(this.radiusType){ rad = ir.hydratedRadius(ion); } else{ rad = ir.radius(ion); }
273274275276277278279280281282283
this.arrayl.add(new Double(assocK)); if(assocK!=0.0D)this.nonZeroAssocK++; double rad = 0.0D; if(this.includeIc){ if(this.radiusType){ rad = ir.hydratedRadius(ion); } else{ rad = ir.radius(ion); }
314315316317318319320321322323324
this.arrayl.add(new Double(concnB)); if(concnA>0.0D || concnB>0.0)this.nonZeroConcns++; this.arrayl.add(new Double(0.0D)); double rad = 0.0D; if(this.radiusType){ rad = ir.hydratedRadius(ion); } else{ rad = ir.radius(ion); } if(rad==0.0D){
353354355356357358359360361362363
if(concnA>0.0D || concnB>0.0)this.nonZeroConcns++; this.arrayl.add(new Double(0.0D)); double rad = 0.0D; if(this.includeIc){ if(this.radiusType){ rad = ir.hydratedRadius(ion); } else{ rad = ir.radius(ion); }
200201202203204205206207208209210
IonicRadii ir = new IonicRadii(); this.vec.add(ion); this.vec.add(new Double(concn)); double rad = 0.0D; if(this.radiusType){ rad = ir.hydratedRadius(ion); } else{ rad = ir.radius(ion); } if(rad==0.0D){
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