HI,
I doubt tleap can do this.
You can mutate the amino acids in any other program (eg: maestro) before exporting the protein, make sure you have deleted
All the hydrogens, then load it in leap, it should work.
Best Regards
Elvis Martis
Ph.D. Student (Computational Chemistry)
at Bombay College of Pharmacy
A Kalina, Santacruz [E], Mumbai 400098, INDIA
W www.elvismartis.in
Skype. adrian_elvis12
-----Original Message-----
From: Thakur, Abhishek [mailto:axt651.miami.edu]
Sent: Friday, January 27, 2017 11:30 PM
To: amber.ambermd.org
Subject: [AMBER] is there any way by which I can use tleap to do mutation?
Hi
everyone
In my system I want to mutate few amino acids, making changes with other software is giving me some error.
I want to know is there any way by which I can use tleap to do mutation?
Thanking you,
-AT
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Received on Sat Jan 28 2017 - 21:30:03 PST
