@@ -85,6 +85,7 @@ Changes from version 2.4 which are relevant for users:
...
@@ -85,6 +85,7 @@ Changes from version 2.4 which are relevant for users:
- New shortcuts are available for selecting atoms: `@allatoms` and `@mdatoms` (see \ref atomSpecs).
- New shortcuts are available for selecting atoms: `@allatoms` and `@mdatoms` (see \ref atomSpecs).
- When using \ref MOLINFO, also the following shortcuts are available for selecting atoms: `@nucleic`, `@protein`, `@water`, `@ions`, `@hydrogens`, `@nonhydrogens`.
- When using \ref MOLINFO, also the following shortcuts are available for selecting atoms: `@nucleic`, `@protein`, `@water`, `@ions`, `@hydrogens`, `@nonhydrogens`.
- When using \ref MOLINFO, individual atoms can be chosen also from water molecules (e.g. `@OW-100`).
- When using \ref MOLINFO, individual atoms can be chosen also from water molecules (e.g. `@OW-100`).
- Additional switching function COSINUS contributed by Michael King
Changes from version 2.4 which are relevant for developers:
Changes from version 2.4 which are relevant for developers:
- Code has been cleanup up replacing a number of pointers with `std::unique_ptr`. All `delete` statements
- Code has been cleanup up replacing a number of pointers with `std::unique_ptr`. All `delete` statements
