!C99Shell v. 1.0 pre-release build #13!

Software: Apache. PHP/5.5.15 

uname -a: Windows NT SVR-DMZ 6.1 build 7600 (Windows Server 2008 R2 Enterprise Edition) i586 

SYSTEM 

Safe-mode: OFF (not secure)

C:\Intranet\C\xampp\php\PEAR\Science\Chemistry\test\   drwxrwxrwx
Free 4.09 GB of 39.52 GB (10.35%)
Detected drives: [ a ] [ c ] [ d ] [ e ] [ f ]
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Viewing file:     testPDB.php (481 B)      -rw-rw-rw-
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<?php
set_time_limit(0);

require "Science/Chemistry/PDBFile.php";
$file = new Science_Chemistry_PDBFile("small.pdb");
//$file = new Science_Chemistry_PDBFile("1hca.pdb");
for ($j=0; $j < $file->num_macromolecules; $j++) {
    $mol =& $file->macromolecules[$j];
    echo $mol->toCML("model", ($j + 1));
    /*
    for ($i=0; $i < $mol->num_molecules; $i++) {
        echo $mol->molecules[$i]->id." - atoms: ";
        echo $mol->molecules[$i]->num_atoms."\n";
    }
    */
    echo "\n================\n\n";
}

?>

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