From bc5d79665306920ac9b7c5e6f856eaddb8b78a5b Mon Sep 17 00:00:00 2001 From: dsehnal <david.sehnal@gmail.com> Date: Thu, 4 Mar 2021 19:14:35 +0100 Subject: [PATCH] make pairingThreshold slightly larger --- src/mol-model/structure/structure/unit/bonds/inter-compute.ts | 2 +- src/mol-model/structure/structure/unit/bonds/intra-compute.ts | 2 +- 2 files changed, 2 insertions(+), 2 deletions(-) diff --git a/src/mol-model/structure/structure/unit/bonds/inter-compute.ts b/src/mol-model/structure/structure/unit/bonds/inter-compute.ts index c21fd0743..e0bc479ae 100644 --- a/src/mol-model/structure/structure/unit/bonds/inter-compute.ts +++ b/src/mol-model/structure/structure/unit/bonds/inter-compute.ts @@ -153,7 +153,7 @@ function findPairBonds(unitA: Unit.Atomic, unitB: Unit.Atomic, props: BondComput ? thresholdAB : beI < 0 ? thresholdA - : (thresholdA + getElementThreshold(beI)) / 2; // not sure if avg or min but max is too big + : (thresholdA + getElementThreshold(beI)) / 1.95; // not sure if avg or min but max is too big if (dist <= pairingThreshold) { const atomIdB = label_atom_idB.value(bI); diff --git a/src/mol-model/structure/structure/unit/bonds/intra-compute.ts b/src/mol-model/structure/structure/unit/bonds/intra-compute.ts index 5f852099f..03ff72f63 100644 --- a/src/mol-model/structure/structure/unit/bonds/intra-compute.ts +++ b/src/mol-model/structure/structure/unit/bonds/intra-compute.ts @@ -211,7 +211,7 @@ function findBonds(unit: Unit.Atomic, props: BondComputationProps): IntraUnitBon ? thresholdAB : beI < 0 ? thresholdA - : (thresholdA + getElementThreshold(beI)) / 2; // not sure if avg or min but max is too big + : (thresholdA + getElementThreshold(beI)) / 1.95; // not sure if avg or min but max is too big if (dist <= pairingThreshold) { atomA[atomA.length] = _aI; -- GitLab