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Implement System generation from output files
enhancementNew feature or requestNew feature or requestgood first issueGood for newcomersGood for newcomersStatus: Open.#110 In GES-compchem/GES-comp-echem;- Status: Open.#108 In GES-compchem/GES-comp-echem;
Implement pKa calculation using CREST built-in function
enhancementNew feature or requestNew feature or requestStatus: Open.#82 In GES-compchem/GES-comp-echem;Define standard coloring scheme for VMD based render tools
enhancementNew feature or requestNew feature or requestgood first issueGood for newcomersGood for newcomerspriority-lowIssue has a low priorityIssue has a low priorityStatus: Open.#76 In GES-compchem/GES-comp-echem;NAMD engine implementation
enhancementNew feature or requestNew feature or requestStatus: Open.#74 In GES-compchem/GES-comp-echem;The VMD labels overlap with the 3D representation of atoms and bonds
enhancementNew feature or requestNew feature or requesthelp wantedExtra attention is neededExtra attention is neededpriority-lowIssue has a low priorityIssue has a low priorityStatus: Open.#73 In GES-compchem/GES-comp-echem;