18 Commits

Author	SHA1	Message	Date
root	f5babc522c	analyse	2024-10-05 19:28:24 +08:00
root	023d72a3f0	plot svg	2024-10-05 19:27:47 +08:00
root	642f35760c	add plot_rmsd.sh	2024-10-05 19:08:54 +08:00
root	e33f462d15	add test script	2024-10-05 15:10:17 +08:00
root	3847ccb2ff	change md run time	2024-10-05 14:48:49 +08:00
root	b166b2bf6a	remove	2024-10-05 14:42:29 +08:00
root	06e5a0f94b	big update	2024-10-05 14:41:52 +08:00
root	dbd3e452be	add plot script	2024-10-05 14:41:34 +08:00
root	4913d6fc8d	add mole	2024-09-26 19:11:16 +08:00
root	b00b76f9f8	add mole sobtop	2024-09-26 18:04:18 +08:00
root	507b843060	add RESP script with nogui version	2024-09-26 18:03:40 +08:00
root	bf2b289c67	add all	2024-09-26 16:39:11 +08:00
root	c7c02e9a7f	remove	2024-09-26 16:36:29 +08:00
lingyu zeng	2b654ce581	update	2024-09-25 18:29:48 +08:00
lingyuzeng	308333d97e	add protein and ligand	2024-09-19 21:12:59 +08:00
lingyu zeng	f67fb6c270	add gpu_id	2024-09-18 19:31:58 +08:00
lingyu zeng	82d60391bf	update	2024-09-18 15:11:00 +08:00
lingyu zeng	ded062a855	update	2024-09-18 14:46:44 +08:00