Clazz.declarePackage("J.adapter.readers.more");
Clazz.load(["J.adapter.smarter.AtomSetCollectionReader"], "J.adapter.readers.more.TlsDataOnlyReader", ["java.util.Hashtable", "JU.Lst", "$.P3", "$.PT", "$.SB", "JU.Escape", "$.Logger"], function(){
var c$ = Clazz.decorateAsClass(function(){
this.vTlsModels = null;
this.sbTlsErrors = null;
this.tlsGroupID = 0;
Clazz.instantialize(this, arguments);}, J.adapter.readers.more, "TlsDataOnlyReader", J.adapter.smarter.AtomSetCollectionReader);
Clazz.overrideMethod(c$, "initializeReader", 
function(){
this.readTlsData();
this.continuing = false;
});
Clazz.defineMethod(c$, "readTlsData", 
function(){
this.vTlsModels =  new JU.Lst();
var tlsGroups;
var tlsGroup = null;
var ranges = null;
var range = null;
tlsGroups =  new JU.Lst();
while (this.rd() != null) {
var tokens = JU.PT.getTokens(this.line.$replace('\'', ' '));
if (tokens.length == 0) continue;
if (tokens[0].equals("TLS")) {
tlsGroup =  new java.util.Hashtable();
ranges =  new JU.Lst();
tlsGroup.put("ranges", ranges);
tlsGroups.addLast(tlsGroup);
tlsGroup.put("id", Integer.$valueOf(++this.tlsGroupID));
} else if (tokens[0].equals("RANGE")) {
range =  new java.util.Hashtable();
var chain1 = tokens[1].charAt(0);
var chain2 = tokens[3].charAt(0);
var res1 = JU.PT.parseInt(tokens[2]);
var res2 = JU.PT.parseInt(tokens[4]);
if (chain1 == chain2) {
range.put("chains", "" + chain1 + chain2);
if (res1 <= res2) {
range.put("residues",  Clazz.newIntArray(-1, [res1, res2]));
ranges.addLast(range);
} else {
this.tlsAddError(" TLS group residues are not in order (range ignored)");
}} else {
this.tlsAddError(" TLS group chains are different (range ignored)");
}} else if (tokens[0].equals("ORIGIN")) {
var origin =  new JU.P3();
tlsGroup.put("origin", origin);
origin.set(this.parseFloatStr(tokens[1]), this.parseFloatStr(tokens[2]), this.parseFloatStr(tokens[3]));
if (Float.isNaN(origin.x) || Float.isNaN(origin.y) || Float.isNaN(origin.z)) {
origin.set(NaN, NaN, NaN);
this.tlsAddError("invalid origin: " + this.line);
}} else if (tokens[0].equals("T") || tokens[0].equals("L") || tokens[0].equals("S")) {
var tensorType = tokens[0].charAt(0);
var nn = (tensorType == 'S' ? J.adapter.readers.more.TlsDataOnlyReader.Snn : J.adapter.readers.more.TlsDataOnlyReader.TLnn);
var tensor =  Clazz.newFloatArray (3, 3, 0);
tlsGroup.put("t" + tensorType, tensor);
for (var i = 1; i < tokens.length; i++) {
var ti = (nn[i].charAt(0)).charCodeAt(0) - 49;
var tj = (nn[i].charAt(1)).charCodeAt(0) - 49;
tensor[ti][tj] = this.parseFloatStr(tokens[++i]);
if (ti < tj) tensor[tj][ti] = tensor[ti][tj];
}
if (tensorType == 'S') tensor[0][0] = -tensor[0][0];
for (var i = 0; i < 3; i++) for (var j = 0; j < 3; j++) if (Float.isNaN(tensor[i][j])) {
this.tlsAddError("invalid tensor: " + JU.Escape.escapeFloatAA(tensor, false));
}

}}
JU.Logger.info(this.tlsGroupID + " TLS groups read");
var groups =  new java.util.Hashtable();
groups.put("groupCount", Integer.$valueOf(this.tlsGroupID));
groups.put("groups", tlsGroups);
this.vTlsModels.addLast(groups);
this.htParams.put("vTlsModels", this.vTlsModels);
});
Clazz.defineMethod(c$, "tlsAddError", 
function(error){
if (this.sbTlsErrors == null) this.sbTlsErrors =  new JU.SB();
this.sbTlsErrors.append(this.fileName).appendC('\t').append("TLS group ").appendI(this.tlsGroupID).appendC('\t').append(error).appendC('\n');
}, "~S");
c$.TLnn =  Clazz.newArray(-1, ["11", "22", "33", "12", "13", "23"]);
c$.Snn =  Clazz.newArray(-1, ["22", "11", "12", "13", "23", "21", "31", "32"]);
});
;//5.0.1-v7 Thu May 08 14:17:10 CDT 2025
