Beispiel #1
0
 /// <summary>
 /// Constructor.
 /// <param name="inchi">InChI string</param>
 /// <param name="opts">Options</param>
 /// </summary>
 public NInchiInputInchi(string inchi, IEnumerable <InChIOption> opts)
 {
     Inchi   = inchi;
     Options = NInchiWrapper.CheckOptions(opts);
 }
Beispiel #2
0
 /// <summary>
 /// Constructor.
 /// </summary>
 /// <param name="opts">List of options.</param>
 public NInchiInput(IList <InChIOption> opts)
 {
     Options = NInchiWrapper.CheckOptions(opts);
 }
Beispiel #3
0
 /// <summary>
 /// Constructor.
 /// <param name="inchi">InChI string</param>
 /// <param name="opts">Options</param>
 /// </summary>
 public NInchiInputInchi(string inchi, string opts)
 {
     this.Inchi   = inchi;
     this.Options = NInchiWrapper.CheckOptions(opts);
 }
Beispiel #4
0
 /// <summary>
 /// Constructor.
 /// </summary>
 /// <param name="opts">Options string.</param>
 public NInchiInput(string opts)
 {
     Options = opts == null ? "" : NInchiWrapper.CheckOptions(opts);
 }