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Windows InChI version use '/' for parsing options.
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johnmay committed Jan 8, 2017
1 parent dcfa4d1 commit ac87989
Showing 1 changed file with 15 additions and 5 deletions.
Expand Up @@ -34,6 +34,16 @@ public class JniInChIInputAdapter extends JniInchiInput {

public static final String FIVE_SECOND_TIMEOUT = "-W5";

/**
* Flag indicating windows or linux.
*/
private static final boolean IS_WINDOWS = System.getProperty("os.name", "").toLowerCase().startsWith("windows");

/**
* Switch character for passing options. / in windows, - on other systems.
*/
private static final String FLAG_CHAR = IS_WINDOWS ? "/" : "-";

public JniInChIInputAdapter(String options) throws JniInchiException {
this.options = options == null ? "" : checkOptions(options);
}
Expand Down Expand Up @@ -76,27 +86,27 @@ private static String checkOptions(final String ops) throws JniInchiException {

INCHI_OPTION option = INCHI_OPTION.valueOfIgnoreCase(op);
if (option != null) {
sbOptions.append('-').append(option.name());
sbOptions.append(FLAG_CHAR).append(option.name());
if (tok.hasMoreTokens()) {
sbOptions.append(" ");
}
} else if (isTimeoutOptions(op)) {
sbOptions.append('-').append(op);
sbOptions.append(FLAG_CHAR).append(op);
hasUserSpecifiedTimeout = true;
if (tok.hasMoreTokens()) {
sbOptions.append(" ");
}
}
// 1,5 tautomer option
else if ("15T".equals(op)) {
sbOptions.append('-').append("15T");
sbOptions.append(FLAG_CHAR).append("15T");
if (tok.hasMoreTokens()) {
sbOptions.append(" ");
}
}
// keto-enol tautomer option
else if ("KET".equals(op)) {
sbOptions.append('-').append("KET");
sbOptions.append(FLAG_CHAR).append("KET");
if (tok.hasMoreTokens()) {
sbOptions.append(" ");
}
Expand All @@ -122,7 +132,7 @@ private static String checkOptions(List<INCHI_OPTION> ops) throws JniInchiExcept
StringBuilder sbOptions = new StringBuilder();

for (INCHI_OPTION op : ops) {
sbOptions.append('-').append(op.name()).append(" ");
sbOptions.append(FLAG_CHAR).append(op.name()).append(" ");
}

if (sbOptions.length() > 0)
Expand Down

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