indigo-node/Indigo/bingo/postgres/sql/common/bingo_config.sql.in

Indigo nodejs bindings

create table bingo_config(cname varchar(255), cvalue varchar(255));
insert into bingo_config(cname, cvalue) values ('TREAT_X_AS_PSEUDOATOM', '0');
insert into bingo_config(cname, cvalue) values ('IGNORE_CLOSING_BOND_DIRECTION_MISMATCH', '0');
insert into bingo_config(cname, cvalue) values ('IGNORE_CISTRANS_ERRORS', '0');
insert into bingo_config(cname, cvalue) values ('IGNORE_STEREOCENTER_ERRORS', '0');
insert into bingo_config(cname, cvalue) values ('ALLOW_NON_UNIQUE_DEAROMATIZATION', '0');
insert into bingo_config(cname, cvalue) values ('ZERO_UNKNOWN_AROMATIC_HYDROGENS', '0');
insert into bingo_config(cname, cvalue) values ('STEREOCHEMISTRY_BIDIRECTIONAL_MODE', '0');
insert into bingo_config(cname, cvalue) values ('STEREOCHEMISTRY_DETECT_HAWORTH_PROJECTION', '0');
insert into bingo_config(cname, cvalue) values ('REJECT_INVALID_STRUCTURES', '0');
insert into bingo_config(cname, cvalue) values ('FP_ORD_SIZE', '25');
insert into bingo_config(cname, cvalue) values ('FP_ANY_SIZE', '15');
insert into bingo_config(cname, cvalue) values ('FP_TAU_SIZE', '10');
insert into bingo_config(cname, cvalue) values ('FP_SIM_SIZE', '8');
insert into bingo_config(cname, cvalue) values ('SUB_SCREENING_MAX_BITS', '8');
insert into bingo_config(cname, cvalue) values ('SIM_SCREENING_PASS_MARK', '128');
insert into bingo_config(cname, cvalue) values ('NTHREADS', '-1');
insert into bingo_config(cname, cvalue) values ('TIMEOUT', '60000');


create table bingo_tau_config(rule_idx integer, tau_beg text, tau_end text);
insert into bingo_tau_config(rule_idx, tau_beg, tau_end) values (1, 'N,O,P,S,As,Se,Sb,Te', 'N,O,P,S,As,Se,Sb,Te');
insert into bingo_tau_config(rule_idx, tau_beg, tau_end) values (2, '0C', 'N,O,P,S');
insert into bingo_tau_config(rule_idx, tau_beg, tau_end) values (3, '1C', 'N,O');
COMMIT;