| /dports/devel/z88dk/z88dk/src/z80asm/lib/ |
| H A D | str.h | 97 extern void Str_sync_len(Str *str);
101 extern void Str_append(Str *str, const char *source);
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| /dports/science/votca/votca-2021.2-18560-gfbe18d971/csg/csg-da5c1dc/src/libcsg/modules/io/ |
| H A D | xmltopologyreader.cc | 97 string molname = it.getAttribute<string>("name"); in ParseMolecules() local
101 string molname = it.getAttribute<string>("name"); in ParseMolecules() local
137 void XMLTopologyReader::ParseMolecule(tools::Property &p, string molname, in ParseMolecule()
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| /dports/security/palisade/palisade-release-d76213499af44558170cca6c72c5314755fec23c/src/pke/include/ |
| H A D | cryptocontext-ser.h | 51 namespace lbcrypto {
|
| /dports/net-p2p/go-ethereum/aws-sdk-go-v2-credentials-v1.1.1/service/s3control/ |
| H A D | api_op_PutPublicAccessBlock.go | 66 if err != nil {
67 return err
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| /dports/science/votca/votca-2021.2-18560-gfbe18d971/csg/src/libcsg/modules/io/ |
| H A D | gmxtopologyreader.cc | 66 std::string molname = *(mol->name); in ReadTopology() local
|
| /dports/science/cdk/cdk-cdk-2.3/storage/io/src/main/java/org/openscience/cdk/io/ |
| H A D | HINWriter.java | 158 String molname = "mol " + (molnum + 1) + " " + mol.getTitle(); in writeAtomContainer() local
|
| /dports/science/molscript/MolScript-280abee/code/ |
| H A D | coord.c | 29 static char *molname = NULL; variable
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| H A D | opengl.c | 89 char *molname; member
|
| /dports/science/votca/votca-2021.2-18560-gfbe18d971/xtp/src/libxtp/ |
| H A D | md2qmengine.cc | 147 std::string molname = mol->get("mdname").as<std::string>(); in map() local
|
| /dports/science/votca/votca-2021.2-18560-gfbe18d971/xtp/xtp-2a31d70/src/libxtp/ |
| H A D | md2qmengine.cc | 147 std::string molname = mol->get("mdname").as<std::string>(); in map() local
|
| /dports/science/openbabel/openbabel-3.1.1/src/formats/ |
| H A D | cofformat.cpp | 337 std::string molname(tit); in WriteMolecule() local
|
| /dports/science/mpqc/mpqc-2.3.1/src/bin/mpqc/ |
| H A D | mpqc.cc | 568 char * molname = keyval->pcharvalue("filename", molnamedef); in try_main() local
|
| /dports/biology/ncbi-toolkit/ncbi/biostruc/newVSch/ |
| H A D | cVSMmdbcmd.cpp | 113 string molname = "QUERY PROTEIN"; in ReadReqAndPDBSubmission() local
|
| /dports/science/gromacs/gromacs-2021.4/src/gromacs/gmxpreprocess/ |
| H A D | pdb2top.cpp | 688 const char* molname, in write_top()
1483 const char* molname, in pdb2top()
|
| H A D | pdb2gmx.cpp | 2455 std::string molname; in run() local
|
| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
| H A D | topology_generate_util.F | 102 CHARACTER(LEN=default_string_length) :: molname local
145 RECURSIVE SUBROUTINE generate_molname_low(i, atom_bond_list, molname, id_molname) argument
148 CHARACTER(LEN=default_string_length), INTENT(IN) :: molname local
|
| H A D | force_fields_util.F | 412 CHARACTER(LEN=default_string_length) :: atmname, molname local
|
| H A D | topology_constraint_util.F | 97 CHARACTER(LEN=default_string_length) :: molname, name local
|
| H A D | topology_util.F | 97 CHARACTER(LEN=default_string_length), POINTER :: molname(:), telement(:), & local
|
| /dports/science/cp2k-data/cp2k-7.1.0/src/ |
| H A D | topology_generate_util.F | 102 CHARACTER(LEN=default_string_length) :: molname local
145 RECURSIVE SUBROUTINE generate_molname_low(i, atom_bond_list, molname, id_molname) argument
148 CHARACTER(LEN=default_string_length), INTENT(IN) :: molname local
|
| H A D | force_fields_util.F | 412 CHARACTER(LEN=default_string_length) :: atmname, molname local
|
| H A D | topology_constraint_util.F | 97 CHARACTER(LEN=default_string_length) :: molname, name local
|
| /dports/science/gromacs/gromacs-2021.4/src/gromacs/swap/ |
| H A D | swapcoords.cpp | 172 char* molname = nullptr; /**< Name of the group or ion type */ member
1851 static int get_index_of_distant_atom(t_compartment* comp, const char molname[]) in get_index_of_distant_atom()
|
| /dports/science/multiwfn/gMultiwfn-3.4.1-0-14-ge873677/src/ |
| H A D | fileIO.f90 | 3894 subroutine outDaltoninp(dalname,molname,ifileid) argument
3896 character(len=*) dalname,molname local
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| /dports/science/gromacs/gromacs-2021.4/src/gromacs/mdtypes/ |
| H A D | inputrec.h | 277 char* molname; member
|