/src/rdkit/Code/DataStructs/BitVect.cpp
Line | Count | Source |
1 | | // $Id$ |
2 | | // |
3 | | // Copyright (c) 2003-2008 greg Landrum and Rational Discovery LLC |
4 | | // |
5 | | // @@ All Rights Reserved @@ |
6 | | // This file is part of the RDKit. |
7 | | // The contents are covered by the terms of the BSD license |
8 | | // which is included in the file license.txt, found at the root |
9 | | // of the RDKit source tree. |
10 | | // |
11 | | #include "BitVect.h" |
12 | | #include <sstream> |
13 | | #include <limits> |
14 | | #include <RDGeneral/StreamOps.h> |
15 | | #include "base64.h" |
16 | | #ifdef WIN32 |
17 | | #include <ios> |
18 | | #endif |
19 | | #include <cstdint> |
20 | | |
21 | 0 | BitVect::~BitVect() {}; // must always implement virtual destructors |
22 | | |
23 | | void BitVect::initFromText(const char *data, const unsigned int dataLen, |
24 | 0 | bool isBase64, bool allowOldFormat) { |
25 | 0 | std::stringstream ss(std::ios_base::binary | std::ios_base::in | |
26 | 0 | std::ios_base::out); |
27 | 0 | if (isBase64) { |
28 | 0 | unsigned int actualLen; |
29 | 0 | char *decoded; |
30 | 0 | decoded = Base64Decode((const char *)data, &actualLen); |
31 | 0 | ss.write(decoded, actualLen); |
32 | 0 | delete[] decoded; |
33 | 0 | } else { |
34 | 0 | ss.write(data, dataLen); |
35 | 0 | } |
36 | |
|
37 | 0 | std::int32_t format = 0; |
38 | 0 | std::int32_t version = 0; |
39 | 0 | std::uint32_t nOn = 0; |
40 | 0 | std::int32_t size; |
41 | | |
42 | | // earlier versions of the code did not have the version number encoded, so |
43 | | // we'll use that to distinguish version 0 |
44 | 0 | RDKit::streamRead(ss, size); |
45 | 0 | if (size < 0) { |
46 | 0 | version = -1 * size; |
47 | 0 | switch (version) { |
48 | 0 | case 16: |
49 | 0 | format = 1; |
50 | 0 | break; |
51 | 0 | case 32: |
52 | 0 | format = 2; |
53 | 0 | break; |
54 | 0 | default: |
55 | 0 | throw ValueErrorException("bad version in BitVect pickle"); |
56 | 0 | break; |
57 | 0 | } |
58 | 0 | RDKit::streamRead(ss, size); |
59 | 0 | } else if (!allowOldFormat) { |
60 | 0 | throw ValueErrorException("invalid BitVect pickle"); |
61 | 0 | } |
62 | | |
63 | 0 | RDKit::streamRead(ss, nOn); |
64 | 0 | _initForSize(static_cast<int>(size)); |
65 | | |
66 | | // if the either have older version or or version 16 with ints for on bits |
67 | 0 | if ((format == 0) || |
68 | 0 | ((format == 1) && (size >= std::numeric_limits<unsigned short>::max()))) { |
69 | 0 | std::uint32_t tmp; |
70 | 0 | for (unsigned int i = 0; i < nOn; i++) { |
71 | 0 | RDKit::streamRead(ss, tmp); |
72 | 0 | setBit(tmp); |
73 | 0 | } |
74 | 0 | } else if (format == 1) { // version 16 and on bits stored as short ints |
75 | 0 | std::uint16_t tmp; |
76 | 0 | for (unsigned int i = 0; i < nOn; i++) { |
77 | 0 | RDKit::streamRead(ss, tmp); |
78 | 0 | setBit(tmp); |
79 | 0 | } |
80 | 0 | } else if (format == 2) { // run length encoded format |
81 | 0 | std::uint32_t curr = 0; |
82 | 0 | for (unsigned int i = 0; i < nOn; i++) { |
83 | 0 | curr += RDKit::readPackedIntFromStream(ss); |
84 | 0 | setBit(curr); |
85 | 0 | curr++; |
86 | 0 | } |
87 | 0 | } |
88 | 0 | } |