Thank you, Dr Mei. :)
Yip Yew Mun (Mr) | PhD Research Scholar | Division of Chemistry & Biological Chemistry
School of Physical & Mathematical Sciences | Nanyang Technological University | Singapore 639798
Tel: (+65) 97967803 | Email: yipy0010.e.ntu.edu.sg | GMT+8h
> On 16 Jul 2015, at 11:18 pm, ymei <ymei.itcs.ecnu.edu.cn> wrote:
>
> Hi Yew Mun,
>
> If you insist on using restrained ESP fit, you may use this code
> https://github.com/samuelymei/HME
>
> Best regards,
>
> Ye
>
> On 2015-07-16 23:01, Yip Yew Mun wrote:
>> Hi,
>>
>> I wish to ask if it’s possible to do RESP charge fitting based on
>> atomic multipoles. If there are papers that suggest the combination of
>> RESP charge fitting with atomic multipoles, please let me know. :)
>>
>> Yip Yew Mun (Mr) | PhD Research Scholar | Division of Chemistry &
>> Biological Chemistry
>> School of Physical & Mathematical Sciences | Nanyang Technological
>> University | Singapore 639798
>> Tel: (+65) 97967803 | Email: yipy0010.e.ntu.edu.sg | GMT+8h
>>
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Received on Thu Jul 16 2015 - 09:00:02 PDT
