c***r 发帖数: 4631 | 1 劳驾推荐一个。
最好能够做纳米复合材料模拟的。
谢谢 |
a***n 发帖数: 578 | 2 which properties you want to simulate?
By the way, curious how much your group can afford to a software?
【在 c***r 的大作中提到】![](/moin_static193/solenoid/img/up.png) : 劳驾推荐一个。 : 最好能够做纳米复合材料模拟的。 : 谢谢
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c***r 发帖数: 4631 | 3
mechanical properties, and is there anything free?
【在 a***n 的大作中提到】![](/moin_static193/solenoid/img/up.png) : which properties you want to simulate? : By the way, curious how much your group can afford to a software?
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a***n 发帖数: 578 | 4 many are free. your boss just want a free software?
【在 c***r 的大作中提到】![](/moin_static193/solenoid/img/up.png) : : mechanical properties, and is there anything free?
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c***r 发帖数: 4631 | 5 of course, if there are something free, why pay for it?
【在 a***n 的大作中提到】![](/moin_static193/solenoid/img/up.png) : many are free. your boss just want a free software?
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a***n 发帖数: 578 | 6 without an interface, how can you create a complex structures?
MD core is quite simple, several line program will do it. That is why most of
MD programs are free. Free means not perfect.
【在 c***r 的大作中提到】![](/moin_static193/solenoid/img/up.png) : of course, if there are something free, why pay for it?
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c***r 发帖数: 4631 | 7 by hand, write xyz or pdb file, or write some C code to create complex
structure.
of
【在 a***n 的大作中提到】![](/moin_static193/solenoid/img/up.png) : without an interface, how can you create a complex structures? : MD core is quite simple, several line program will do it. That is why most of : MD programs are free. Free means not perfect.
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a***n 发帖数: 578 | 8
^^^^^^^^^^ this sounds time-consuming. some simulation involves million atoms.
hehe. anyway, good luck. Amber, Lammps are best free softwares.
【在 c***r 的大作中提到】![](/moin_static193/solenoid/img/up.png) : by hand, write xyz or pdb file, or write some C code to create complex : structure. : : of
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b*******u 发帖数: 62 | 9 with interface u can use as black box
【在 a***n 的大作中提到】![](/moin_static193/solenoid/img/up.png) : without an interface, how can you create a complex structures? : MD core is quite simple, several line program will do it. That is why most of : MD programs are free. Free means not perfect.
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c***r 发帖数: 4631 | 10 thank you, but is Amber free?
atoms.
most
software?
【在 a***n 的大作中提到】![](/moin_static193/solenoid/img/up.png) : : ^^^^^^^^^^ this sounds time-consuming. some simulation involves million atoms. : hehe. anyway, good luck. Amber, Lammps are best free softwares.
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b*******u 发帖数: 62 | 11 no.
hehe
【在 c***r 的大作中提到】![](/moin_static193/solenoid/img/up.png) : thank you, but is Amber free? : : atoms. : most : software?
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r*****d 发帖数: 54 | 12 MD是骗人的东西,还是不要用的好
【在 c***r 的大作中提到】![](/moin_static193/solenoid/img/up.png) : 劳驾推荐一个。 : 最好能够做纳米复合材料模拟的。 : 谢谢
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