From 80a53a5f3982a341bde267411c4ab2332cdfa627 Mon Sep 17 00:00:00 2001 From: Xavier Robin <xavalias-github@xavier.robin.name> Date: Thu, 6 Jun 2024 10:30:47 +0200 Subject: [PATCH] test: SCHWED-6331 support for ? and . too --- modules/io/src/mol/mmcif_reader.cc | 11 +++++++---- 1 file changed, 7 insertions(+), 4 deletions(-) diff --git a/modules/io/src/mol/mmcif_reader.cc b/modules/io/src/mol/mmcif_reader.cc index 9ab20c5e2..932d065ab 100644 --- a/modules/io/src/mol/mmcif_reader.cc +++ b/modules/io/src/mol/mmcif_reader.cc @@ -1702,12 +1702,15 @@ void MMCifReader::ParseStructRefSeqDif(const std::vector<StringRef>& columns) "pdbx_seq_db_seq_num"); return; } + std::pair<bool,int> seq_rnum; if (indices_[SRSD_SEQ_RNUM] != -1) { - seq_rnum=this->TryGetInt(columns[indices_[SRSD_SEQ_RNUM]], - "_struct_ref_seq_dif.seq_num", - profile_.fault_tolerant); - + StringRef col = columns[indices_[SRSD_SEQ_RNUM]]; + if (col.size()!=1 || (col[0]!='?' && col[0]!='.')) { + seq_rnum=this->TryGetInt(col, + "_struct_ref_seq_dif.seq_num", + profile_.fault_tolerant); + } } if (!seq_rnum.first) { LOG_INFO("Ignoring struct_ref_seq_dif with missing data item " -- GitLab