How or where can I get the crystallographic information file (CIF) for PCN-222 MOF?

I need the simulated XRD pattern of PCN-222 to compare with experimental data. Thanks.

19 February 2021 4,932 3 View

How can I obtain the expansion orbital coeffiecients in Hartree Fock program?

23 December 2020 6,756 3 View

4D rotations and rotors.. can a general expression be derived?

I recently asked in math stackexchange a question regarding 3D rotations in geometric algebra https://math.stackexchange.com/questions/3922021/angle-and-plane-of-rotation-in-3d-geometric-algebra....

07 December 2020 5,630 26 View

How to compute pressure drop on liquid ammonia line?

I have to analyze an existing ammonia line to estimate the pressure drop in it. The line is designed to transport liquid ammonia. I can compute the pressure drop with standard friction factor...

21 November 2020 5,494 3 View

Does anyone know of a qualitative research article that addresses the role of the CEO and/or Top Management Teams in ambidextrous strategies?

I am interested only in papers with a qualitative approach to explore the link between personality of top management team human resource management (including the CEO) and open innovation. Thanks...

19 November 2020 1,785 7 View

In R software, how to restrict geographical area only to the coastline / intertidal zone?

Hello all! I'm trying to conduct an SDM analysis in R regarding a species which only occurs in the intertidal area. I need to be able to restrict my geographical range to a range of points in...

13 November 2020 351 9 View

It is said that Faith and Science are frontally confronted, a good Scientist cannot be a Believer or practice any Religion or Religious Belief?

The relationships between Science, Beliefs and Faith have always generated a heated debate (which has reached popular opinion) leading to think that they are irreconcilable concepts and that a...

26 October 2020 2,389 99 View

SDM and intertidal species?

Hello all. I have a technical question regarding species distribution models on intertidal species. The main issue here is the fact although the species in question are associated with intertidal...

12 October 2020 2,108 2 View

Hot to convert s-1 to cm3 molecule-1 s-1 in kinetics?

Hi all, I have a conversion problem with rate constant calculations. My start point is the isoprene molecule with a chlorine atom bond to C1. I want to obtain the rate constant of: isoprene +...

27 September 2020 3,192 3 View

How to do non parametric chi square test in SPSS?

I want to run non parametric chi square test. Appreciate your help.

24 September 2020 1,373 2 View

MD MOE RMSD

How to calculate the RMSD values for a MD simulation using MOE?

07 August 2021 0 0 View

MD MOE RMSD

How to calculate the RMSD values for a MD simulation using MOE?

07 August 2021 0 0 View

fatal error

When I tried to energy minimization my system, I got fatal error as below. Fatal error: Atomtype opls_116 not found Although I've already added this line: ; include water #include "oplsaa.ff/spc.itp" to [molecultype] directive in my topology.

16 June 2021 0 0 View

fatal error

When I tried to energy minimization my system, I got fatal error as below. Fatal error: Atomtype opls_116 not found Although I've already added this line: ; include water #include "oplsaa.ff/spc.itp" to [molecultype] directive in my topology.

16 June 2021 0 0 View

fatal error

When I tried to energy minimization my system, I got fatal error as below. Fatal error: Atomtype opls_116 not found Although I've already added this line: ; include water #include "oplsaa.ff/spc.itp" to [molecultype] directive in my topology.

16 June 2021 0 0 View

fatal error

When I tried to energy minimization my system, I got fatal error as below. Fatal error: Atomtype opls_116 not found Although I've already added this line: ; include water #include "oplsaa.ff/spc.itp" to [molecultype] directive in my topology.

16 June 2021 0 0 View

How can I measure MMP-1 protein activity or protein level from liver tissue?

Instead of checking only the mRNA level, I want to check the active protein level of MMP-1 in Liver tissue from mice. How can I do that?

03 March 2021 1,763 2 View

What kind of fluid could I use for a pitfall trap that also does not invalidate molecular testing?

Hi, I want to start testing pitfall trap to obtain ants samples, but I need to conduct molecular analysis on those insects. So, what kind of fluid can I use? Ethanol expires too early and I need...

03 March 2021 5,978 5 View

Buffer to disrupt platelet alpha granules for PF4 quantification?

Hello! I want to quantify by ELISA the secreted (from platelets poor plasma) and the non-secreted (from platelet lysate) PF4 before and after TRAP stimulation. I will use the ELISA from R&D...

03 March 2021 1,499 2 View

Buffer Exchange using column packed with sephadex G-25 effect on protein concentration?

Hello, If i am doing a buffer exchange for an antibody of 1mg/mL, does the elution lose protein in the process of buffer exchange? For example, if i flow through 500 uL of 1mg/mL sample, and...

03 March 2021 6,299 3 View