Thank you so much Jarrett, yes it works very well!
On Thu, 20 Jul 2023 at 08:51, Jarrett Johnson <
jarrett.john...@schrodinger.com> wrote:
> Sorry, typo. For the second approach, state should be `i + 1` and not `-1`"
>
> Jarrett J.
>
> On Thu, Jul 20, 2023 at 8:49 AM Jarrett Johnson <
> jarrett.j
Sorry, typo. For the second approach, state should be `i + 1` and not `-1`"
Jarrett J.
On Thu, Jul 20, 2023 at 8:49 AM Jarrett Johnson <
jarrett.john...@schrodinger.com> wrote:
> Hi Neena,
>
> Is the split_states necessary? You can query the distance between atoms on
> the state-level as well wi
Hi Neena,
Is the split_states necessary? You can query the distance between atoms on
the state-level as well without having to break up your structure. Here's
two approaches that show either way; I recommend the second if possible.
You'll of course have to switch out the selection string to fit yo